1-(5-butyl-1,2,4-triazol-1-yl)-1-(1-phenyl-5-pyridin-3-yl-2H-1,2,3,4-tetrazol-3-yl)pentan-2-one

Systemtic Name: 1-(5-butyl-1,2,4-triazol-1-yl)-1-(1-phenyl-5-pyridin-3-yl-2H-1,2,3,4-tetrazol-3-yl)pentan-2-one Openeye Name: 1-(5-butyl-1,2,4-triazol-1-yl)-1-[1-phenyl-5-(3-pyridyl)-2H-tetrazol-3-yl]pentan-2-one CAS Name: 1-(5-butyl-1,2,4-triazol-1-yl)-1-[1-phenyl-5-(3-pyridinyl)-2H-tetrazol-3-yl]-2-pentanone IUPAC Name: 1-(5-butyl-1,2,4-triazol-1-yl)-1-(1-phenyl-5-pyridin-3-yl-2H-tetrazol-3-yl)pentan-2-one Traditional Name: 1-(5-butyl-1,2,4-triazol-1-yl)-1-[1-phenyl-5-(3-pyridyl)-2H-tetrazol-3-yl]pentan-2-one Formula: C23H28N8O MolecularWeight: 432.52142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=NN1C(C(=O)CCC)N2NN(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=NC=NN1C(C(=O)CCC)N2NN(C(=N2)C3=CN=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N8O/c1-3-5-14-21-25-17-26-30(21)23(20(32)10-4-2)31-27-22(18-11-9-15-24-16-18)29(28-31)19-12-7-6-8-13-19/h6-9,11-13,15-17,23,28H,3-5,10,14H2,1-2H3