2-[2-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-N-propyl-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide

Systemtic Name: 2-[2-[(4-chlorophenyl)-pyridin-2-yl-methyl]piperazin-1-yl]-N-propyl-N-(2H-1,2,3,4-tetrazol-5-yl)benzamide Openeye Name: 2-[2-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazin-1-yl]-N-propyl-N-(2H-tetrazol-5-yl)benzamide CAS Name: 2-[2-[(4-chlorophenyl)-(2-pyridinyl)methyl]-1-piperazinyl]-N-propyl-N-(2H-tetrazol-5-yl)benzamide IUPAC Name: 2-[2-[(4-chlorophenyl)-pyridin-2-ylmethyl]piperazin-1-yl]-N-propyl-N-(2H-tetrazol-5-yl)benzamide Traditional Name: 2-[2-[(4-chlorophenyl)-(2-pyridyl)methyl]piperazino]-N-propyl-N-(2H-tetrazol-5-yl)benzamide Formula: C27H29ClN8O MolecularWeight: 517.02516

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=NNN=N1)C(=O)C2=CC=CC=C2N3CCNCC3C(C4=CC=C(C=C4)Cl)C5=CC=CC=N5

Isomeric SMILES

CCCN(C1=NNN=N1)C(=O)C2=CC=CC=C2N3CCNCC3C(C4=CC=C(C=C4)Cl)C5=CC=CC=N5

InChI

InChI=1S/C27H29ClN8O/c1-2-16-36(27-31-33-34-32-27)26(37)21-7-3-4-9-23(21)35-17-15-29-18-24(35)25(22-8-5-6-14-30-22)19-10-12-20(28)13-11-19/h3-14,24-25,29H,2,15-18H2,1H3,(H,31,32,33,34)