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

Systemtic Name: ethyl 4-[(4-ethylcyclohexyl)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(4-ethylcyclohexyl)carbamothioylamino]benzoate CAS Name: 4-[[[(4-ethylcyclohexyl)amino]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(4-ethylcyclohexyl)carbamothioylamino]benzoate Traditional Name: 4-[(4-ethylcyclohexyl)thiocarbamoylamino]benzoic acid ethyl ester Formula: C18H26N2O2S MolecularWeight: 334.47624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

Isomeric SMILES

CCC1CCC(CC1)NC(=S)NC2=CC=C(C=C2)C(=O)OCC

InChI

InChI=1S/C18H26N2O2S/c1-3-13-5-9-15(10-6-13)19-18(23)20-16-11-7-14(8-12-16)17(21)22-4-2/h7-8,11-13,15H,3-6,9-10H2,1-2H3,(H2,19,20,23)