3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-4-pyrrolidin-1-ylphenyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-methyl-4-pyrrolidino-phenyl)benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)N2CCCC2)NC(=O)C3=CC(=C(C=C3)OC)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-19-17-21(27-13-7-8-14-27)10-11-22(19)26-25(29)20-9-12-23(32-2)24(18-20)33(30,31)28-15-5-3-4-6-16-28/h9-12,17-18H,3-8,13-16H2,1-2H3,(H,26,29)