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

Systemtic Name: N-(1-methylbenzimidazol-2-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-(1-methylbenzimidazol-2-yl)thiazole-4-carboxamide CAS Name: N-(1-methyl-2-benzimidazolyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-methylbenzimidazol-2-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-(1-methylbenzimidazol-2-yl)thiazole-4-carboxamide Formula: C26H26N6O2S2 MolecularWeight: 518.65364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)C5=C(N=CC=C5)SCC=C

Isomeric SMILES

CN1C2=CC=CC=C2N=C1NC(=O)C3=CSC(=N3)C4CCN(CC4)C(=O)C5=C(N=CC=C5)SCC=C

InChI

InChI=1S/C26H26N6O2S2/c1-3-15-35-24-18(7-6-12-27-24)25(34)32-13-10-17(11-14-32)23-28-20(16-36-23)22(33)30-26-29-19-8-4-5-9-21(19)31(26)2/h3-9,12,16-17H,1,10-11,13-15H2,2H3,(H,29,30,33)