methyl 2-[(4-ethoxyphenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(4-ethoxyphenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(4-ethoxyphenyl)carbamothioylamino]-5-ethyl-thiophene-3-carboxylate CAS Name: 2-[[(4-ethoxyanilino)-sulfanylidenemethyl]amino]-5-ethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-ethoxyphenyl)carbamothioylamino]-5-ethylthiophene-3-carboxylate Traditional Name: 5-ethyl-2-(p-phenetylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C17H20N2O3S2 MolecularWeight: 364.4823

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NC2=CC=C(C=C2)OCC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NC2=CC=C(C=C2)OCC)C(=O)OC

InChI

InChI=1S/C17H20N2O3S2/c1-4-13-10-14(16(20)21-3)15(24-13)19-17(23)18-11-6-8-12(9-7-11)22-5-2/h6-10H,4-5H2,1-3H3,(H2,18,19,23)