N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2-pyridin-3-yl-1,3-thiazole-4-carboxamide

Systemtic Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2-pyridin-3-yl-1,3-thiazole-4-carboxamide Openeye Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2-(3-pyridyl)thiazole-4-carboxamide CAS Name: N-[[3-[3-(1-piperazinylmethyl)phenyl]phenyl]methyl]-2-(3-pyridinyl)-4-thiazolecarboxamide IUPAC Name: N-[[3-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]-2-pyridin-3-yl-1,3-thiazole-4-carboxamide Traditional Name: N-[3-[3-(piperazinomethyl)phenyl]benzyl]-2-(3-pyridyl)thiazole-4-carboxamide Formula: C27H27N5OS MolecularWeight: 469.60118

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CSC(=N4)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCN1)CC2=CC=CC(=C2)C3=CC(=CC=C3)CNC(=O)C4=CSC(=N4)C5=CN=CC=C5

InChI

InChI=1S/C27H27N5OS/c33-26(25-19-34-27(31-25)24-8-3-9-29-17-24)30-16-20-4-1-6-22(14-20)23-7-2-5-21(15-23)18-32-12-10-28-11-13-32/h1-9,14-15,17,19,28H,10-13,16,18H2,(H,30,33)