ethyl 2-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(2,5-dimethylphenyl)-5-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(2,5-dimethylphenyl)-5-methyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[(2-chloropyridine-3-carbonyl)amino]-4-(2,5-dimethylphenyl)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]-4-(2,5-dimethylphenyl)-5-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[(2-chloropyridine-3-carbonyl)amino]-4-(2,5-dimethylphenyl)-5-methylthiophene-3-carboxylate Traditional Name: 2-[(2-chloronicotinoyl)amino]-4-(2,5-dimethylphenyl)-5-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C22H21ClN2O3S MolecularWeight: 428.93174

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21ClN2O3S/c1-5-28-22(27)18-17(16-11-12(2)8-9-13(16)3)14(4)29-21(18)25-20(26)15-7-6-10-24-19(15)23/h6-11H,5H2,1-4H3,(H,25,26)