ethyl 3-[(6-chloranylpyridin-3-yl)carbonylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate

Systemtic Name: ethyl 3-[(6-chloranylpyridin-3-yl)carbonylamino]-5-(3-nitrophenyl)thiophene-2-carboxylate Openeye Name: ethyl 3-[(6-chloropyridine-3-carbonyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylate CAS Name: 3-[[(6-chloro-3-pyridinyl)-oxomethyl]amino]-5-(3-nitrophenyl)-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(6-chloropyridine-3-carbonyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylate Traditional Name: 3-[(6-chloronicotinoyl)amino]-5-(3-nitrophenyl)thiophene-2-carboxylic acid ethyl ester Formula: C19H14ClN3O5S MolecularWeight: 431.84956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C19H14ClN3O5S/c1-2-28-19(25)17-14(22-18(24)12-6-7-16(20)21-10-12)9-15(29-17)11-4-3-5-13(8-11)23(26)27/h3-10H,2H2,1H3,(H,22,24)