2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide

Systemtic Name: 2-(8-methoxy-4-methyl-quinolin-2-yl)sulfanyl-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide Openeye Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(8-methoxy-4-methyl-2-quinolyl)sulfanyl]butanamide CAS Name: 2-[(8-methoxy-4-methyl-2-quinolinyl)thio]-N-[4-[(phenylmethyl)sulfamoyl]phenyl]butanamide IUPAC Name: N-[4-(benzylsulfamoyl)phenyl]-2-(8-methoxy-4-methylquinolin-2-yl)sulfanylbutanamide Traditional Name: N-[4-(benzylsulfamoyl)phenyl]-2-[(8-methoxy-4-methyl-2-quinolyl)thio]butyramide Formula: C28H29N3O4S2 MolecularWeight: 535.67756

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC4=C(C=CC=C4OC)C(=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC2=CC=CC=C2)SC3=NC4=C(C=CC=C4OC)C(=C3)C

InChI

InChI=1S/C28H29N3O4S2/c1-4-25(36-26-17-19(2)23-11-8-12-24(35-3)27(23)31-26)28(32)30-21-13-15-22(16-14-21)37(33,34)29-18-20-9-6-5-7-10-20/h5-17,25,29H,4,18H2,1-3H3,(H,30,32)