ethyl 2-[(2-methylphenyl)carbamothioylamino]-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-methylphenyl)carbamothioylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: ethyl 2-(o-tolylcarbamothioylamino)-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[(2-methylanilino)-sulfanylidenemethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-methylphenyl)carbamothioylamino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-(o-tolylthiocarbamoylamino)-4-(2-thienyl)thiophene-3-carboxylic acid ethyl ester Formula: C19H18N2O2S3 MolecularWeight: 402.55342

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=S)NC3=CC=CC=C3C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CS2)NC(=S)NC3=CC=CC=C3C

InChI

InChI=1S/C19H18N2O2S3/c1-3-23-18(22)16-13(15-9-6-10-25-15)11-26-17(16)21-19(24)20-14-8-5-4-7-12(14)2/h4-11H,3H2,1-2H3,(H2,20,21,24)