N-(2H-benzotriazol-5-yl)-2-[1-(2-prop-2-enylsulfanylpyridin-3-yl)carbonylpiperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(2H-benzotriazol-5-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-(2H-benzotriazol-5-yl)thiazole-4-carboxamide CAS Name: N-(2H-benzotriazol-5-yl)-2-[1-[oxo-[2-(prop-2-enylthio)-3-pyridinyl]methyl]-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(2H-benzotriazol-5-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-(2H-benzotriazol-5-yl)thiazole-4-carboxamide Formula: C24H23N7O2S2 MolecularWeight: 505.61512

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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=NNN=C5C=C4

Isomeric SMILES

C=CCSC1=C(C=CC=N1)C(=O)N2CCC(CC2)C3=NC(=CS3)C(=O)NC4=CC5=NNN=C5C=C4

InChI

InChI=1S/C24H23N7O2S2/c1-2-12-34-23-17(4-3-9-25-23)24(33)31-10-7-15(8-11-31)22-27-20(14-35-22)21(32)26-16-5-6-18-19(13-16)29-30-28-18/h2-6,9,13-15H,1,7-8,10-12H2,(H,26,32)(H,28,29,30)