ethyl 4-(4-methoxyphenyl)-2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxyphenyl)-2-[(2-methylsulfanylpyridin-3-yl)carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-(4-methoxyphenyl)-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]thiophene-3-carboxylate CAS Name: 4-(4-methoxyphenyl)-2-[[[2-(methylthio)-3-pyridinyl]-oxomethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxyphenyl)-2-[(2-methylsulfanylpyridine-3-carbonyl)amino]thiophene-3-carboxylate Traditional Name: 4-(4-methoxyphenyl)-2-[[2-(methylthio)nicotinoyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)OC)NC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C21H20N2O4S2/c1-4-27-21(25)17-16(13-7-9-14(26-2)10-8-13)12-29-20(17)23-18(24)15-6-5-11-22-19(15)28-3/h5-12H,4H2,1-3H3,(H,23,24)