(2E)-N-methyl-2-[(2-methylpropan-2-yl)oxyimino]-1-quinolin-3-yl-cyclohexane-1-carbothioamide

Systemtic Name: (2E)-N-methyl-2-[(2-methylpropan-2-yl)oxyimino]-1-quinolin-3-yl-cyclohexane-1-carbothioamide Openeye Name: (2E)-2-tert-butoxyimino-N-methyl-1-(3-quinolyl)cyclohexanecarbothioamide CAS Name: (2E)-N-methyl-2-[(2-methylpropan-2-yl)oxyimino]-1-(3-quinolinyl)-1-cyclohexanecarbothioamide IUPAC Name: (2E)-N-methyl-2-[(2-methylpropan-2-yl)oxyimino]-1-quinolin-3-ylcyclohexane-1-carbothioamide Traditional Name: (2E)-2-tert-butyloximino-N-methyl-1-(3-quinolyl)cyclohexanecarbothioamide Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)ON=C1CCCCC1(C2=CC3=CC=CC=C3N=C2)C(=S)NC

Isomeric SMILES

CC(C)(C)O/N=C/1\CCCCC1(C2=CC3=CC=CC=C3N=C2)C(=S)NC

InChI

InChI=1S/C21H27N3OS/c1-20(2,3)25-24-18-11-7-8-12-21(18,19(26)22-4)16-13-15-9-5-6-10-17(15)23-14-16/h5-6,9-10,13-14H,7-8,11-12H2,1-4H3,(H,22,26)/b24-18+