5-chloranyl-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-(4-phenylsulfanylphenyl)phenyl]ethyl]benzamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-(4-phenylsulfanylphenyl)phenyl]ethyl]benzamide Openeye Name: 5-chloro-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-(4-phenylsulfanylphenyl)phenyl]ethyl]benzamide CAS Name: 5-chloro-2-methoxy-N-[2-[3-[[methylamino(sulfanylidene)methyl]sulfamoyl]-4-[4-(phenylthio)phenyl]phenyl]ethyl]benzamide IUPAC Name: 5-chloro-2-methoxy-N-[2-[3-(methylcarbamothioylsulfamoyl)-4-(4-phenylsulfanylphenyl)phenyl]ethyl]benzamide Traditional Name: 5-chloro-2-methoxy-N-[2-[3-(methylthiocarbamoylsulfamoyl)-4-[4-(phenylthio)phenyl]phenyl]ethyl]benzamide Formula: C30H28ClN3O4S3 MolecularWeight: 626.20902

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC)C3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

CNC(=S)NS(=O)(=O)C1=C(C=CC(=C1)CCNC(=O)C2=C(C=CC(=C2)Cl)OC)C3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C30H28ClN3O4S3/c1-32-30(39)34-41(36,37)28-18-20(16-17-33-29(35)26-19-22(31)11-15-27(26)38-2)8-14-25(28)21-9-12-24(13-10-21)40-23-6-4-3-5-7-23/h3-15,18-19H,16-17H2,1-2H3,(H,33,35)(H2,32,34,39)