3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-piperidin-1-ylphenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-piperidin-1-ylphenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-[2-(1-piperidyl)phenyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-(1-piperidinyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-piperidin-1-ylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-piperidinophenyl)benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2N3CCCCC3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2N3CCCCC3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-32-23-14-13-20(19-24(23)33(30,31)28-17-9-2-3-10-18-28)25(29)26-21-11-5-6-12-22(21)27-15-7-4-8-16-27/h5-6,11-14,19H,2-4,7-10,15-18H2,1H3,(H,26,29)