2-(azepan-1-yl)-2-oxidanylidene-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]ethanamide

Systemtic Name: 2-(azepan-1-yl)-2-oxidanylidene-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]ethanamide Openeye Name: 2-(azepan-1-yl)-2-oxo-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]acetamide CAS Name: 2-(1-azepanyl)-2-oxo-N-[2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]acetamide IUPAC Name: 2-(azepan-1-yl)-2-oxo-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]acetamide Traditional Name: 2-(azepan-1-yl)-2-keto-N-[2-(4-pyrrolidinosulfonylphenyl)ethyl]acetamide Formula: C20H29N3O4S MolecularWeight: 407.52696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

C1CCCN(CC1)C(=O)C(=O)NCCC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H29N3O4S/c24-19(20(25)22-13-3-1-2-4-14-22)21-12-11-17-7-9-18(10-8-17)28(26,27)23-15-5-6-16-23/h7-10H,1-6,11-16H2,(H,21,24)