ethyl 3-[[cyclohexyl(prop-2-enyl)carbamothioyl]amino]benzoate

Systemtic Name: ethyl 3-[[cyclohexyl(prop-2-enyl)carbamothioyl]amino]benzoate Openeye Name: ethyl 3-[[allyl(cyclohexyl)carbamothioyl]amino]benzoate CAS Name: 3-[[[cyclohexyl(prop-2-enyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[cyclohexyl(prop-2-enyl)carbamothioyl]amino]benzoate Traditional Name: 3-[[allyl(cyclohexyl)thiocarbamoyl]amino]benzoic acid ethyl ester Formula: C19H26N2O2S MolecularWeight: 346.48694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H26N2O2S/c1-3-13-21(17-11-6-5-7-12-17)19(24)20-16-10-8-9-15(14-16)18(22)23-4-2/h3,8-10,14,17H,1,4-7,11-13H2,2H3,(H,20,24)