ethyl 4-[(cyclohexylcarbamothioylamino)carbamothioylamino]benzoate

Systemtic Name: ethyl 4-[(cyclohexylcarbamothioylamino)carbamothioylamino]benzoate Openeye Name: ethyl 4-[(cyclohexylcarbamothioylamino)carbamothioylamino]benzoate CAS Name: 4-[[[[(cyclohexylamino)-sulfanylidenemethyl]hydrazo]-sulfanylidenemethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(cyclohexylcarbamothioylamino)carbamothioylamino]benzoate Traditional Name: 4-[(cyclohexylthiocarbamoylamino)thiocarbamoylamino]benzoic acid ethyl ester Formula: C17H24N4O2S2 MolecularWeight: 380.52806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC(=S)NC2CCCCC2

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=S)NNC(=S)NC2CCCCC2

InChI

InChI=1S/C17H24N4O2S2/c1-2-23-15(22)12-8-10-14(11-9-12)19-17(25)21-20-16(24)18-13-6-4-3-5-7-13/h8-11,13H,2-7H2,1H3,(H2,18,20,24)(H2,19,21,25)