N-[4-[5-azanyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,2,3-triazol-1-yl]phenyl]ethanamide

Systemtic Name: N-[4-[5-azanyl-4-(4-pyridin-2-ylpiperazin-1-yl)carbonyl-1,2,3-triazol-1-yl]phenyl]ethanamide Openeye Name: N-[4-[5-amino-4-[4-(2-pyridyl)piperazine-1-carbonyl]triazol-1-yl]phenyl]acetamide CAS Name: N-[4-[5-amino-4-[oxo-[4-(2-pyridinyl)-1-piperazinyl]methyl]-1-triazolyl]phenyl]acetamide IUPAC Name: N-[4-[5-amino-4-(4-pyridin-2-ylpiperazine-1-carbonyl)triazol-1-yl]phenyl]acetamide Traditional Name: N-[4-[5-amino-4-[4-(2-pyridyl)piperazine-1-carbonyl]triazol-1-yl]phenyl]acetamide Formula: C20H22N8O2 MolecularWeight: 406.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N3CCN(CC3)C4=CC=CC=N4)N

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)N2C(=C(N=N2)C(=O)N3CCN(CC3)C4=CC=CC=N4)N

InChI

InChI=1S/C20H22N8O2/c1-14(29)23-15-5-7-16(8-6-15)28-19(21)18(24-25-28)20(30)27-12-10-26(11-13-27)17-4-2-3-9-22-17/h2-9H,10-13,21H2,1H3,(H,23,29)