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

Systemtic Name: methyl 2-[(2-ethoxycarbonylphenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(2-ethoxycarbonylphenyl)carbamothioylamino]-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2-ethoxycarbonylanilino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(2-ethoxycarbonylphenyl)carbamothioylamino]-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-carbethoxyphenyl)thiocarbamoylamino]-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=S)NC2=C(C=C(S2)C)C(=O)OC

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=S)NC2=C(C=C(S2)C)C(=O)OC

InChI

InChI=1S/C17H18N2O4S2/c1-4-23-16(21)11-7-5-6-8-13(11)18-17(24)19-14-12(15(20)22-3)9-10(2)25-14/h5-9H,4H2,1-3H3,(H2,18,19,24)