N-(2-cyanoethyl)-2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2-cyanoethyl)-2-[1-(5-methyl-1-phenyl-pyrazol-4-yl)carbonylpiperidin-4-yl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: N-(2-cyanoethyl)-2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: N-(2-cyanoethyl)-2-[1-[(5-methyl-1-phenyl-4-pyrazolyl)-oxomethyl]-4-piperidinyl]-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: N-(2-cyanoethyl)-2-[1-(5-methyl-1-phenylpyrazole-4-carbonyl)piperidin-4-yl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: N-(2-cyanoethyl)-2-[1-(5-methyl-1-phenyl-pyrazole-4-carbonyl)-4-piperidyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C29H29N7O2S MolecularWeight: 539.65126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)N(CCC#N)CC5=CN=CC=C5

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC=C2)C(=O)N3CCC(CC3)C4=NC(=CS4)C(=O)N(CCC#N)CC5=CN=CC=C5

InChI

InChI=1S/C29H29N7O2S/c1-21-25(18-32-36(21)24-8-3-2-4-9-24)28(37)34-15-10-23(11-16-34)27-33-26(20-39-27)29(38)35(14-6-12-30)19-22-7-5-13-31-17-22/h2-5,7-9,13,17-18,20,23H,6,10-11,14-16,19H2,1H3