N-methyl-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-N-prop-2-ynyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-methyl-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]-N-methyl-N-prop-2-ynyl-thiazole-4-carboxamide CAS Name: N-methyl-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-N-prop-2-ynyl-4-thiazolecarboxamide IUPAC Name: N-methyl-2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-N-prop-2-ynyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]-N-methyl-N-propargyl-thiazole-4-carboxamide Formula: C22H24N4O2S2 MolecularWeight: 440.58156

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)C(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SCC=C

Isomeric SMILES

CN(CC#C)C(=O)C1=CSC(=N1)C2CCN(CC2)C(=O)C3=C(N=CC=C3)SCC=C

InChI

InChI=1S/C22H24N4O2S2/c1-4-11-25(3)22(28)18-15-30-19(24-18)16-8-12-26(13-9-16)21(27)17-7-6-10-23-20(17)29-14-5-2/h1,5-7,10,15-16H,2,8-9,11-14H2,3H3