2-[methyl-(1-pyridin-3-ylcyclohexyl)carbothioyl-amino]ethyl ethanoate

Systemtic Name: 2-[methyl-(1-pyridin-3-ylcyclohexyl)carbothioyl-amino]ethyl ethanoate Openeye Name: 2-[methyl-[1-(3-pyridyl)cyclohexanecarbothioyl]amino]ethyl acetate CAS Name: acetic acid 2-[methyl-[[1-(3-pyridinyl)cyclohexyl]-sulfanylidenemethyl]amino]ethyl ester IUPAC Name: 2-[methyl-(1-pyridin-3-ylcyclohexanecarbothioyl)amino]ethyl acetate Traditional Name: acetic acid 2-[methyl-[1-(3-pyridyl)cyclohexanecarbothioyl]amino]ethyl ester Formula: C17H24N2O2S MolecularWeight: 320.44966

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCCN(C)C(=S)C1(CCCCC1)C2=CN=CC=C2

Isomeric SMILES

CC(=O)OCCN(C)C(=S)C1(CCCCC1)C2=CN=CC=C2

InChI

InChI=1S/C17H24N2O2S/c1-14(20)21-12-11-19(2)16(22)17(8-4-3-5-9-17)15-7-6-10-18-13-15/h6-7,10,13H,3-5,8-9,11-12H2,1-2H3