propyl 2-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate

Systemtic Name: propyl 2-[(2-chloranylpyridin-3-yl)carbonylamino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Openeye Name: propyl 2-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[[(2-chloro-3-pyridinyl)-oxomethyl]amino]-4-(4-methoxyphenyl)-3-thiophenecarboxylic acid propyl ester IUPAC Name: propyl 2-[(2-chloropyridine-3-carbonyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-[(2-chloronicotinoyl)amino]-4-(4-methoxyphenyl)thiophene-3-carboxylic acid propyl ester Formula: C21H19ClN2O4S MolecularWeight: 430.90456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H19ClN2O4S/c1-3-11-28-21(26)17-16(13-6-8-14(27-2)9-7-13)12-29-20(17)24-19(25)15-5-4-10-23-18(15)22/h4-10,12H,3,11H2,1-2H3,(H,24,25)