ethyl 1-[1-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate

Systemtic Name: ethyl 1-[1-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-5-propan-2-yl-pyrazol-4-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[5-isopropyl-1-[4-(2-naphthyl)thiazol-2-yl]pyrazole-4-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[1-[4-(2-naphthalenyl)-2-thiazolyl]-5-propan-2-yl-4-pyrazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(4-naphthalen-2-yl-1,3-thiazol-2-yl)-5-propan-2-ylpyrazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[5-isopropyl-1-[4-(2-naphthyl)thiazol-2-yl]pyrazole-4-carbonyl]nipecotic acid ethyl ester Formula: C28H30N4O3S MolecularWeight: 502.6278

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC5=CC=CC=C5C=C4)C(C)C

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=C(N(N=C2)C3=NC(=CS3)C4=CC5=CC=CC=C5C=C4)C(C)C

InChI

InChI=1S/C28H30N4O3S/c1-4-35-27(34)22-10-7-13-31(16-22)26(33)23-15-29-32(25(23)18(2)3)28-30-24(17-36-28)21-12-11-19-8-5-6-9-20(19)14-21/h5-6,8-9,11-12,14-15,17-18,22H,4,7,10,13,16H2,1-3H3