2-(2-cyanophenyl)sulfanyl-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-(2-methoxy-5-piperidin-1-ylsulfonyl-phenyl)benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-[2-methoxy-5-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-[2-methoxy-5-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-(2-methoxy-5-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-(2-methoxy-5-piperidinosulfonyl-phenyl)benzamide Formula: C26H25N3O4S2 MolecularWeight: 507.6244

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)NC(=O)C3=CC=CC=C3SC4=CC=CC=C4C#N

InChI

InChI=1S/C26H25N3O4S2/c1-33-23-14-13-20(35(31,32)29-15-7-2-8-16-29)17-22(23)28-26(30)21-10-4-6-12-25(21)34-24-11-5-3-9-19(24)18-27/h3-6,9-14,17H,2,7-8,15-16H2,1H3,(H,28,30)