N-(2-cyano-4,5-diethoxy-phenyl)-4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2-cyano-4,5-diethoxy-phenyl)-4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-cyano-4,5-diethoxy-phenyl)-4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-cyano-4,5-diethoxyphenyl)-4-methoxy-3-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-cyano-4,5-diethoxyphenyl)-4-methoxy-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2-cyano-4,5-diethoxy-phenyl)-4-methoxy-3-(4-phenylpiperazino)sulfonyl-benzamide Formula: C29H32N4O6S MolecularWeight: 564.65258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C#N)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C#N)NC(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C29H32N4O6S/c1-4-38-26-17-22(20-30)24(19-27(26)39-5-2)31-29(34)21-11-12-25(37-3)28(18-21)40(35,36)33-15-13-32(14-16-33)23-9-7-6-8-10-23/h6-12,17-19H,4-5,13-16H2,1-3H3,(H,31,34)