2-[[4-(5-chloranyl-2-methyl-phenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[1-(phenylmethyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[4-(5-chloranyl-2-methyl-phenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-N-[1-(phenylmethyl)piperidin-4-yl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[[4-(5-chloro-2-methyl-phenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: 2-[[[4-(5-chloro-2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]thio]methyl]-N-[1-(phenylmethyl)-4-piperidinyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[[4-(5-chloro-2-methylphenyl)-5-pyridin-4-yl-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[[[4-(5-chloro-2-methyl-phenyl)-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C31H30ClN7OS2 MolecularWeight: 616.1992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)C6=CC=NC=C6

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2C(=NN=C2SCC3=NC(=CS3)C(=O)NC4CCN(CC4)CC5=CC=CC=C5)C6=CC=NC=C6

InChI

InChI=1S/C31H30ClN7OS2/c1-21-7-8-24(32)17-27(21)39-29(23-9-13-33-14-10-23)36-37-31(39)42-20-28-35-26(19-41-28)30(40)34-25-11-15-38(16-12-25)18-22-5-3-2-4-6-22/h2-10,13-14,17,19,25H,11-12,15-16,18,20H2,1H3,(H,34,40)