Gemini
3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea;ethyl 2-[(4-chloro-6-methoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate
Molecular Identity
Gemini
3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea;ethyl 2-[(4-chloro-6-methoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoate
PubChem CID: 198713
2D Structure
Properties
C24H25Cl3N6O8S
Molecular Formula
663.90
Molecular Weight
g/mol
662.0520
Exact Mass
Da
187
TPSA
May have limited oral absorption
3
H-Bond Donors
10
H-Bond Acceptors
856
Complexity
SMILES
Canonical SMILES
SMILES: CCOC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC.CN(C(=O)NC1=CC(=C(C=C1)Cl)Cl)OCIsomeric SMILES
SMILES: CCOC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC2=NC(=CC(=N2)Cl)OC.CN(C(=O)NC1=CC(=C(C=C1)Cl)Cl)OCSynonyms(17)
GeminiLorox plus120812-76-2DTXSID40153029Benzoic acid, 2-(((((4-chloro-6-methoxy-2-pyrimidinyl)amino)carbonyl)amino)sulfonyl)-, ethyl ester, mixt. with N'-(3,4-dichlorophenyl)-N-methoxy-N-methylureaRefChem:142859DTXCID0075520(1R,3S,5Z)-5-(2-((1R,4E,7aR)-1-(2,10-dihydroxy-2,10-dimethylundecan-6-yl)-7a-methyl-octahydro-1H-inden-4-ylidene)ethylidene)-4-methylidenecyclohexane-1,3-diol(1R,3S,5Z)-5-{2-[(1R,4E,7aR)-1-(2,10-dihydroxy-2,10-dimethylundecan-6-yl)-7a-methyl-octahydro-1H-inden-4-ylidene]ethylidene}-4-methylidenecyclohexane-1,3-diol1R,25-dihydroxy-21-(3-hydroxy-3-methylbutyl)vitamin D33-(3,4-dichlorophenyl)-1-methoxy-1-methylurea;ethyl 2-[(4-chloro-6-methoxypyrimidin-2-yl)carbamoylsulfamoyl]benzoateorb1697110SCHEMBL31483443AKOS040751903ethyl 2-(N-((4-chloro-6-methoxypyrimidin-2-yl)carbamoyl)sulfamoyl)benzoate compound with 3-(3,4-dichlorophenyl)-1-methoxy-1-methylurea (1:1)
Data from PubChem (NCBI)
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