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

Systemtic Name: N-[1-(phenylmethyl)piperidin-4-yl]-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-2-[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-[1-(phenylmethyl)-4-piperidinyl]-2-[[[4-phenyl-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-2-[(4-phenyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-2-[[[4-phenyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]thiazole-4-carboxamide Formula: C30H29N7OS2 MolecularWeight: 567.72756

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CN=CC=C5)CC6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CSC(=N2)CSC3=NN=C(N3C4=CC=CC=C4)C5=CN=CC=C5)CC6=CC=CC=C6

InChI

InChI=1S/C30H29N7OS2/c38-29(32-24-13-16-36(17-14-24)19-22-8-3-1-4-9-22)26-20-39-27(33-26)21-40-30-35-34-28(23-10-7-15-31-18-23)37(30)25-11-5-2-6-12-25/h1-12,15,18,20,24H,13-14,16-17,19,21H2,(H,32,38)