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

Systemtic Name: 2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[1-(2-allylsulfanylpyridine-3-carbonyl)-4-piperidyl]-N-thiazol-2-yl-thiazole-4-carboxamide CAS Name: 2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-N-(2-thiazolyl)-4-thiazolecarboxamide IUPAC Name: 2-[1-(2-prop-2-enylsulfanylpyridine-3-carbonyl)piperidin-4-yl]-N-(1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[1-[2-(allylthio)nicotinoyl]-4-piperidyl]-N-thiazol-2-yl-thiazole-4-carboxamide Formula: C21H21N5O2S3 MolecularWeight: 471.61874

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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=NC=CS4

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=NC=CS4

InChI

InChI=1S/C21H21N5O2S3/c1-2-11-29-19-15(4-3-7-22-19)20(28)26-9-5-14(6-10-26)18-24-16(13-31-18)17(27)25-21-23-8-12-30-21/h2-4,7-8,12-14H,1,5-6,9-11H2,(H,23,25,27)