N-[2-(azepan-1-yl)ethyl]-2-[methylsulfonyl(phenyl)amino]butanamide

Systemtic Name: N-[2-(azepan-1-yl)ethyl]-2-[methylsulfonyl(phenyl)amino]butanamide Openeye Name: N-[2-(azepan-1-yl)ethyl]-2-(N-methylsulfonylanilino)butanamide CAS Name: N-[2-(1-azepanyl)ethyl]-2-(N-methylsulfonylanilino)butanamide IUPAC Name: N-[2-(azepan-1-yl)ethyl]-2-(N-methylsulfonylanilino)butanamide Traditional Name: N-[2-(azepan-1-yl)ethyl]-2-(N-mesylanilino)butyramide Formula: C19H31N3O3S MolecularWeight: 381.53274

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCCN1CCCCCC1)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NCCN1CCCCCC1)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C19H31N3O3S/c1-3-18(22(26(2,24)25)17-11-7-6-8-12-17)19(23)20-13-16-21-14-9-4-5-10-15-21/h6-8,11-12,18H,3-5,9-10,13-16H2,1-2H3,(H,20,23)