[2-[[2-[2-(4-methoxyphenyl)ethylcarbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate

Systemtic Name: [2-[[2-[2-(4-methoxyphenyl)ethylcarbamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate Openeye Name: [2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]-2-oxo-ethyl] 2-pyrazol-1-ylpyridine-3-carboxylate CAS Name: 2-(1-pyrazolyl)-3-pyridinecarboxylic acid [2-[2-[[2-(4-methoxyphenyl)ethylamino]-oxomethyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]-2-oxoethyl] 2-pyrazol-1-ylpyridine-3-carboxylate Traditional Name: 2-pyrazol-1-ylnicotinic acid [2-keto-2-[2-[2-(4-methoxyphenyl)ethylcarbamoyl]anilino]ethyl] ester Formula: C27H25N5O5 MolecularWeight: 499.5179

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=C(N=CC=C3)N4C=CC=N4

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=C(N=CC=C3)N4C=CC=N4

InChI

InChI=1S/C27H25N5O5/c1-36-20-11-9-19(10-12-20)13-16-29-26(34)21-6-2-3-8-23(21)31-24(33)18-37-27(35)22-7-4-14-28-25(22)32-17-5-15-30-32/h2-12,14-15,17H,13,16,18H2,1H3,(H,29,34)(H,31,33)