N-[(2-chlorophenyl)methyl]-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxamide

Systemtic Name: N-[(2-chlorophenyl)methyl]-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxamide Openeye Name: N-[(2-chlorophenyl)methyl]-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxamide CAS Name: N-[(2-chlorophenyl)methyl]-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)-4-piperidinecarboxamide IUPAC Name: N-[(2-chlorophenyl)methyl]-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxamide Traditional Name: N-(2-chlorobenzyl)-1-(5-propyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)isonipecotamide Formula: C21H25ClN6O MolecularWeight: 412.9158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=NC=NN2C(=C1)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

CCCC1=NC2=NC=NN2C(=C1)N3CCC(CC3)C(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C21H25ClN6O/c1-2-5-17-12-19(28-21(26-17)24-14-25-28)27-10-8-15(9-11-27)20(29)23-13-16-6-3-4-7-18(16)22/h3-4,6-7,12,14-15H,2,5,8-11,13H2,1H3,(H,23,29)