methyl 2-[(3-methoxyphenyl)carbamothioylamino]-4-thiophen-2-yl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-methoxyphenyl)carbamothioylamino]-4-thiophen-2-yl-thiophene-3-carboxylate Openeye Name: methyl 2-[(3-methoxyphenyl)carbamothioylamino]-4-(2-thienyl)thiophene-3-carboxylate CAS Name: 2-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]-4-thiophen-2-yl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(3-methoxyphenyl)carbamothioylamino]-4-thiophen-2-ylthiophene-3-carboxylate Traditional Name: 2-[(3-methoxyphenyl)thiocarbamoylamino]-4-(2-thienyl)thiophene-3-carboxylic acid methyl ester Formula: C18H16N2O3S3 MolecularWeight: 404.52624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC2=C(C(=CS2)C3=CC=CS3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2=C(C(=CS2)C3=CC=CS3)C(=O)OC

InChI

InChI=1S/C18H16N2O3S3/c1-22-12-6-3-5-11(9-12)19-18(24)20-16-15(17(21)23-2)13(10-26-16)14-7-4-8-25-14/h3-10H,1-2H3,(H2,19,20,24)