N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(phenylmethyl)sulfamoyl]benzamide

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(phenylmethyl)sulfamoyl]benzamide Openeye Name: 3-(benzylsulfamoyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(phenylmethyl)sulfamoyl]benzamide IUPAC Name: 3-(benzylsulfamoyl)-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)benzamide Traditional Name: 3-(benzylsulfamoyl)-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)benzamide Formula: C23H21N3O3S2 MolecularWeight: 451.56114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4=CC=CC=C4)C#N

InChI

InChI=1S/C23H21N3O3S2/c24-14-20-19-11-4-5-12-21(19)30-23(20)26-22(27)17-9-6-10-18(13-17)31(28,29)25-15-16-7-2-1-3-8-16/h1-3,6-10,13,25H,4-5,11-12,15H2,(H,26,27)