methyl 4-[(cyclopentylideneamino)carbamothioylamino]benzoate

Systemtic Name: methyl 4-[(cyclopentylideneamino)carbamothioylamino]benzoate Openeye Name: methyl 4-[(cyclopentylideneamino)carbamothioylamino]benzoate CAS Name: 4-[[(2-cyclopentylidenehydrazinyl)-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(cyclopentylideneamino)carbamothioylamino]benzoate Traditional Name: 4-[(cyclopentylideneamino)thiocarbamoylamino]benzoic acid methyl ester Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NN=C2CCCC2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)NN=C2CCCC2

InChI

InChI=1S/C14H17N3O2S/c1-19-13(18)10-6-8-11(9-7-10)15-14(20)17-16-12-4-2-3-5-12/h6-9H,2-5H2,1H3,(H2,15,17,20)