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

Systemtic Name: N-(2-oxidanylideneazepan-3-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-(2-oxoazepan-3-yl)thiazole-4-carboxamide CAS Name: N-(2-oxo-3-azepanyl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2-oxoazepan-3-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-(2-ketoazepan-3-yl)thiazole-4-carboxamide Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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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)NC4CCCCNC4=O

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4CCCCNC4=O

InChI

InChI=1S/C24H29N5O3S2/c1-2-14-33-23-17(6-5-11-26-23)24(32)29-12-8-16(9-13-29)22-28-19(15-34-22)21(31)27-18-7-3-4-10-25-20(18)30/h2,5-6,11,15-16,18H,1,3-4,7-10,12-14H2,(H,25,30)(H,27,31)