N-(3-methyl-1,2-thiazol-5-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-methyl-1,2-thiazol-5-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-(3-methylisothiazol-5-yl)thiazole-4-carboxamide CAS Name: N-(3-methyl-5-isothiazolyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(3-methyl-1,2-thiazol-5-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-(3-methylisothiazol-5-yl)thiazole-4-carboxamide Formula: C22H23N5O2S3 MolecularWeight: 485.64532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

Isomeric SMILES

CC1=NSC(=C1)NC(=O)C2=CSC(=N2)C3CCN(CC3)C(=O)C4=C(N=CC=C4)SCC=C

InChI

InChI=1S/C22H23N5O2S3/c1-3-11-30-21-16(5-4-8-23-21)22(29)27-9-6-15(7-10-27)20-24-17(13-31-20)19(28)25-18-12-14(2)26-32-18/h3-5,8,12-13,15H,1,6-7,9-11H2,2H3,(H,25,28)