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

Systemtic Name: N-(2,3-dihydro-1H-inden-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-indan-2-yl-thiazole-4-carboxamide CAS Name: N-(2,3-dihydro-1H-inden-2-yl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2,3-dihydro-1H-inden-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-indan-2-yl-thiazole-4-carboxamide Formula: C27H28N4O2S2 MolecularWeight: 504.66682

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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)NC4CC5=CC=CC=C5C4

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4CC5=CC=CC=C5C4

InChI

InChI=1S/C27H28N4O2S2/c1-2-14-34-26-22(8-5-11-28-26)27(33)31-12-9-18(10-13-31)25-30-23(17-35-25)24(32)29-21-15-19-6-3-4-7-20(19)16-21/h2-8,11,17-18,21H,1,9-10,12-16H2,(H,29,32)