N-[2-[cyclohexyl(methyl)amino]ethyl]-2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-2-(1-ethyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[(1-ethyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[(1-ethyl-2-oxo-4-quinolinyl)thio]acetamide IUPAC Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-2-(1-ethyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[2-[cyclohexyl(methyl)amino]ethyl]-2-[(1-ethyl-2-keto-4-quinolyl)thio]acetamide Formula: C22H31N3O2S MolecularWeight: 401.56544

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCN(C)C3CCCCC3

Isomeric SMILES

CCN1C2=CC=CC=C2C(=CC1=O)SCC(=O)NCCN(C)C3CCCCC3

InChI

InChI=1S/C22H31N3O2S/c1-3-25-19-12-8-7-11-18(19)20(15-22(25)27)28-16-21(26)23-13-14-24(2)17-9-5-4-6-10-17/h7-8,11-12,15,17H,3-6,9-10,13-14,16H2,1-2H3,(H,23,26)