2-(7-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[3-[methyl-(phenylmethyl)amino]propyl]ethanamide

Systemtic Name: 2-(7-chloranyl-1-methyl-2-oxidanylidene-quinolin-4-yl)sulfanyl-N-[3-[methyl-(phenylmethyl)amino]propyl]ethanamide Openeye Name: N-[3-[benzyl(methyl)amino]propyl]-2-[(7-chloro-1-methyl-2-oxo-4-quinolyl)sulfanyl]acetamide CAS Name: 2-[(7-chloro-1-methyl-2-oxo-4-quinolinyl)thio]-N-[3-[methyl-(phenylmethyl)amino]propyl]acetamide IUPAC Name: N-[3-[benzyl(methyl)amino]propyl]-2-(7-chloro-1-methyl-2-oxoquinolin-4-yl)sulfanylacetamide Traditional Name: N-[3-[benzyl(methyl)amino]propyl]-2-[(7-chloro-2-keto-1-methyl-4-quinolyl)thio]acetamide Formula: C23H26ClN3O2S MolecularWeight: 443.98944

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)Cl)C(=CC1=O)SCC(=O)NCCCN(C)CC3=CC=CC=C3

Isomeric SMILES

CN1C2=C(C=CC(=C2)Cl)C(=CC1=O)SCC(=O)NCCCN(C)CC3=CC=CC=C3

InChI

InChI=1S/C23H26ClN3O2S/c1-26(15-17-7-4-3-5-8-17)12-6-11-25-22(28)16-30-21-14-23(29)27(2)20-13-18(24)9-10-19(20)21/h3-5,7-10,13-14H,6,11-12,15-16H2,1-2H3,(H,25,28)