N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[2-(3-methoxyphenyl)pyrrolidin-1-yl]ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CCCN2CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2CCCN2CC(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C25H33N3O4S/c1-32-22-9-6-8-20(18-22)24-10-7-15-27(24)19-25(29)26-21-11-13-23(14-12-21)33(30,31)28-16-4-2-3-5-17-28/h6,8-9,11-14,18,24H,2-5,7,10,15-17,19H2,1H3,(H,26,29)