N-(3-acetamidophenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide

Systemtic Name: N-(3-acetamidophenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Openeye Name: N-(3-acetamidophenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide CAS Name: N-(3-acetamidophenyl)-3-[4-(1-azepanylsulfonyl)phenyl]propanamide IUPAC Name: N-(3-acetamidophenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propanamide Traditional Name: N-(3-acetamidophenyl)-3-[4-(azepan-1-ylsulfonyl)phenyl]propionamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H29N3O4S/c1-18(27)24-20-7-6-8-21(17-20)25-23(28)14-11-19-9-12-22(13-10-19)31(29,30)26-15-4-2-3-5-16-26/h6-10,12-13,17H,2-5,11,14-16H2,1H3,(H,24,27)(H,25,28)