ethyl 4-[[2-cyanoethyl(cyclohexyl)carbamothioyl]amino]benzoate

Systemtic Name: ethyl 4-[[2-cyanoethyl(cyclohexyl)carbamothioyl]amino]benzoate Openeye Name: ethyl 4-[[2-cyanoethyl(cyclohexyl)carbamothioyl]amino]benzoate CAS Name: 4-[[[2-cyanoethyl(cyclohexyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-cyanoethyl(cyclohexyl)carbamothioyl]amino]benzoate Traditional Name: 4-[[2-cyanoethyl(cyclohexyl)thiocarbamoyl]amino]benzoic acid ethyl ester Formula: C19H25N3O2S MolecularWeight: 359.4857

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CCC#N)C2CCCCC2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)N(CCC#N)C2CCCCC2

InChI

InChI=1S/C19H25N3O2S/c1-2-24-18(23)15-9-11-16(12-10-15)21-19(25)22(14-6-13-20)17-7-4-3-5-8-17/h9-12,17H,2-8,14H2,1H3,(H,21,25)