methyl 4-[(cyclohexylideneamino)carbamothioylamino]benzoate

Systemtic Name: methyl 4-[(cyclohexylideneamino)carbamothioylamino]benzoate Openeye Name: methyl 4-[(cyclohexylideneamino)carbamothioylamino]benzoate CAS Name: 4-[[(2-cyclohexylidenehydrazinyl)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(cyclohexylideneamino)carbamothioylamino]benzoate Traditional Name: 4-[(cyclohexylideneamino)thiocarbamoylamino]benzoic acid methyl ester Formula: C15H19N3O2S MolecularWeight: 305.39526

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NN=C2CCCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NN=C2CCCCC2

InChI

InChI=1S/C15H19N3O2S/c1-20-14(19)11-7-9-12(10-8-11)16-15(21)18-17-13-5-3-2-4-6-13/h7-10H,2-6H2,1H3,(H2,16,18,21)