2-chloranyl-N-(4-methoxyphenyl)-5-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfamoyl]-4-(phenylmethylsulfanyl)benzamide

Systemtic Name: 2-chloranyl-N-(4-methoxyphenyl)-5-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfamoyl]-4-(phenylmethylsulfanyl)benzamide Openeye Name: 4-benzylsulfanyl-2-chloro-N-(4-methoxyphenyl)-5-[(4-oxo-1H-quinazolin-2-yl)sulfamoyl]benzamide CAS Name: 2-chloro-N-(4-methoxyphenyl)-5-[(4-oxo-1H-quinazolin-2-yl)sulfamoyl]-4-(phenylmethylthio)benzamide IUPAC Name: 4-benzylsulfanyl-2-chloro-N-(4-methoxyphenyl)-5-[(4-oxo-1H-quinazolin-2-yl)sulfamoyl]benzamide Traditional Name: 4-(benzylthio)-2-chloro-5-[(4-keto-1H-quinazolin-2-yl)sulfamoyl]-N-(4-methoxyphenyl)benzamide Formula: C29H23ClN4O5S2 MolecularWeight: 607.09972

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)SCC3=CC=CC=C3)S(=O)(=O)NC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2Cl)SCC3=CC=CC=C3)S(=O)(=O)NC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C29H23ClN4O5S2/c1-39-20-13-11-19(12-14-20)31-28(36)22-15-26(25(16-23(22)30)40-17-18-7-3-2-4-8-18)41(37,38)34-29-32-24-10-6-5-9-21(24)27(35)33-29/h2-16H,17H2,1H3,(H,31,36)(H2,32,33,34,35)