methyl 4-[[(E)-thiophen-2-ylmethylideneamino]carbamothioylamino]benzoate

Systemtic Name: methyl 4-[[(E)-thiophen-2-ylmethylideneamino]carbamothioylamino]benzoate Openeye Name: methyl 4-[[(E)-2-thienylmethyleneamino]carbamothioylamino]benzoate CAS Name: 4-[[sulfanylidene-[(2E)-2-(thiophen-2-ylmethylidene)hydrazinyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-thiophen-2-ylmethylideneamino]carbamothioylamino]benzoate Traditional Name: 4-[[(E)-2-thenylideneamino]thiocarbamoylamino]benzoic acid methyl ester Formula: C14H13N3O2S2 MolecularWeight: 319.40192

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=S)NN=CC2=CC=CS2

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC(=S)N/N=C/C2=CC=CS2

InChI

InChI=1S/C14H13N3O2S2/c1-19-13(18)10-4-6-11(7-5-10)16-14(20)17-15-9-12-3-2-8-21-12/h2-9H,1H3,(H2,16,17,20)/b15-9+