3-methyl-2-oxidanylidene-1-quinolin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: 3-methyl-2-oxidanylidene-1-quinolin-3-yl-cyclohexane-1-carbothioamide Openeye Name: 3-methyl-2-oxo-1-(3-quinolyl)cyclohexanecarbothioamide CAS Name: 3-methyl-2-oxo-1-(3-quinolinyl)-1-cyclohexanecarbothioamide IUPAC Name: 3-methyl-2-oxo-1-quinolin-3-ylcyclohexane-1-carbothioamide Traditional Name: 2-keto-3-methyl-1-(3-quinolyl)cyclohexanecarbothioamide Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1=O)(C2=CC3=CC=CC=C3N=C2)C(=S)N

Isomeric SMILES

CC1CCCC(C1=O)(C2=CC3=CC=CC=C3N=C2)C(=S)N

InChI

InChI=1S/C17H18N2OS/c1-11-5-4-8-17(15(11)20,16(18)21)13-9-12-6-2-3-7-14(12)19-10-13/h2-3,6-7,9-11H,4-5,8H2,1H3,(H2,18,21)