ethyl 5-[(2,6-dimethylphenyl)carbamothioylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[(2,6-dimethylphenyl)carbamothioylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[(2,6-dimethylphenyl)carbamothioylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[(2,6-dimethylanilino)-sulfanylidenemethyl]amino]-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(2,6-dimethylphenyl)carbamothioylamino]-3-methylthiophene-2-carboxylate Traditional Name: 5-[(2,6-dimethylphenyl)thiocarbamoylamino]-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C17H20N2O2S2 MolecularWeight: 348.4829

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=S)NC2=C(C=CC=C2C)C)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=S)NC2=C(C=CC=C2C)C)C

InChI

InChI=1S/C17H20N2O2S2/c1-5-21-16(20)15-12(4)9-13(23-15)18-17(22)19-14-10(2)7-6-8-11(14)3/h6-9H,5H2,1-4H3,(H2,18,19,22)