methyl 3-[(2,5-dimethylphenyl)carbamothioylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[(2,5-dimethylphenyl)carbamothioylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[(2,5-dimethylphenyl)carbamothioylamino]thiophene-2-carboxylate CAS Name: 3-[[(2,5-dimethylanilino)-sulfanylidenemethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[(2,5-dimethylphenyl)carbamothioylamino]thiophene-2-carboxylate Traditional Name: 3-[(2,5-dimethylphenyl)thiocarbamoylamino]thiophene-2-carboxylic acid methyl ester Formula: C15H16N2O2S2 MolecularWeight: 320.42974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=S)NC2=C(SC=C2)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=S)NC2=C(SC=C2)C(=O)OC

InChI

InChI=1S/C15H16N2O2S2/c1-9-4-5-10(2)12(8-9)17-15(20)16-11-6-7-21-13(11)14(18)19-3/h4-8H,1-3H3,(H2,16,17,20)