2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-N-quinolin-6-yl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-N-quinolin-6-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]-N-(6-quinolyl)thiazole-4-carboxamide CAS Name: 2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-N-(6-quinolinyl)-4-thiazolecarboxamide IUPAC Name: 2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-N-quinolin-6-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]-N-(6-quinolyl)thiazole-4-carboxamide Formula: C27H25N5O2S2 MolecularWeight: 515.6497

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CC5=C(C=C4)N=CC=C5

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CC5=C(C=C4)N=CC=C5

InChI

InChI=1S/C27H25N5O2S2/c1-2-15-35-26-21(6-4-12-29-26)27(34)32-13-9-18(10-14-32)25-31-23(17-36-25)24(33)30-20-7-8-22-19(16-20)5-3-11-28-22/h2-8,11-12,16-18H,1,9-10,13-15H2,(H,30,33)