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

Systemtic Name: 2-[(4-phenylpiperazin-1-yl)methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-phenylpiperazin-1-yl)methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide CAS Name: 2-[(4-phenyl-1-piperazinyl)methyl]-N-(3-pyridinylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[(4-phenylpiperazin-1-yl)methyl]-N-(pyridin-3-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[(4-phenylpiperazino)methyl]-N-(3-pyridylmethyl)thiazole-4-carboxamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=CS2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC(=CS2)C(=O)NCC3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H23N5OS/c27-21(23-14-17-5-4-8-22-13-17)19-16-28-20(24-19)15-25-9-11-26(12-10-25)18-6-2-1-3-7-18/h1-8,13,16H,9-12,14-15H2,(H,23,27)