N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]-N-(5-tert-butyl-1H-pyrazol-3-yl)thiazole-4-carboxamide CAS Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(5-tert-butyl-1H-pyrazol-3-yl)-2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]-N-(5-tert-butyl-1H-pyrazol-3-yl)thiazole-4-carboxamide Formula: C25H30N6O2S2 MolecularWeight: 510.6747

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=NN1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

Isomeric SMILES

CC(C)(C)C1=CC(=NN1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

InChI

InChI=1S/C25H30N6O2S2/c1-5-13-34-23-17(7-6-10-26-23)24(33)31-11-8-16(9-12-31)22-27-18(15-35-22)21(32)28-20-14-19(29-30-20)25(2,3)4/h5-7,10,14-16H,1,8-9,11-13H2,2-4H3,(H2,28,29,30,32)