N-(1-ethyl-7,7-dimethyl-2-oxidanylidene-azepan-3-yl)-3-phenyl-2-sulfanyl-propanamide

Systemtic Name: N-(1-ethyl-7,7-dimethyl-2-oxidanylidene-azepan-3-yl)-3-phenyl-2-sulfanyl-propanamide Openeye Name: N-(1-ethyl-7,7-dimethyl-2-oxo-azepan-3-yl)-3-phenyl-2-sulfanyl-propanamide CAS Name: N-(1-ethyl-7,7-dimethyl-2-oxo-3-azepanyl)-2-mercapto-3-phenylpropanamide IUPAC Name: N-(1-ethyl-7,7-dimethyl-2-oxoazepan-3-yl)-3-phenyl-2-sulfanylpropanamide Traditional Name: N-(1-ethyl-2-keto-7,7-dimethyl-azepan-3-yl)-2-mercapto-3-phenyl-propionamide Formula: C19H28N2O2S MolecularWeight: 348.50282

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C(CCCC1(C)C)NC(=O)C(CC2=CC=CC=C2)S

Isomeric SMILES

CCN1C(=O)C(CCCC1(C)C)NC(=O)C(CC2=CC=CC=C2)S

InChI

InChI=1S/C19H28N2O2S/c1-4-21-18(23)15(11-8-12-19(21,2)3)20-17(22)16(24)13-14-9-6-5-7-10-14/h5-7,9-10,15-16,24H,4,8,11-13H2,1-3H3,(H,20,22)