ethyl 4-[(4-cyclohexylphenyl)carbamothioylamino]-4-oxidanylidene-butanoate

Systemtic Name: ethyl 4-[(4-cyclohexylphenyl)carbamothioylamino]-4-oxidanylidene-butanoate Openeye Name: ethyl 4-[(4-cyclohexylphenyl)carbamothioylamino]-4-oxo-butanoate CAS Name: 4-[[(4-cyclohexylanilino)-sulfanylidenemethyl]amino]-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 4-[(4-cyclohexylphenyl)carbamothioylamino]-4-oxobutanoate Traditional Name: 4-[(4-cyclohexylphenyl)thiocarbamoylamino]-4-keto-butyric acid ethyl ester Formula: C19H26N2O3S MolecularWeight: 362.48634

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C2CCCCC2

Isomeric SMILES

CCOC(=O)CCC(=O)NC(=S)NC1=CC=C(C=C1)C2CCCCC2

InChI

InChI=1S/C19H26N2O3S/c1-2-24-18(23)13-12-17(22)21-19(25)20-16-10-8-15(9-11-16)14-6-4-3-5-7-14/h8-11,14H,2-7,12-13H2,1H3,(H2,20,21,22,25)