ethyl 2-[(4-ethylphenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(4-ethylphenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(4-ethylphenyl)carbamothioylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[(4-ethylanilino)-sulfanylidenemethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(4-ethylphenyl)carbamothioylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[(4-ethylphenyl)thiocarbamoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H22N2O2S2 MolecularWeight: 362.50948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2O2S2/c1-5-13-7-9-14(10-8-13)19-18(23)20-16-15(17(21)22-6-2)11(3)12(4)24-16/h7-10H,5-6H2,1-4H3,(H2,19,20,23)