ethyl 5-[(3-ethylphenyl)carbamothioylamino]-3-methyl-thiophene-2-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)NC2=CC(=C(S2)C(=O)OCC)C

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)NC2=CC(=C(S2)C(=O)OCC)C

InChI

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