ethyl 4-[(4-oxidanylcyclohexyl)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(4-oxidanylcyclohexyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-hydroxycyclohexyl)carbamothioylamino]benzoate CAS Name: 4-[[[(4-hydroxycyclohexyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-hydroxycyclohexyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-hydroxycyclohexyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C16H22N2O3S MolecularWeight: 322.42248

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CCC(CC2)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NC2CCC(CC2)O

InChI

InChI=1S/C16H22N2O3S/c1-2-21-15(20)11-3-5-12(6-4-11)17-16(22)18-13-7-9-14(19)10-8-13/h3-6,13-14,19H,2,7-10H2,1H3,(H2,17,18,22)