1-[5-butyl-1-(3-methyl-5-phenyl-4-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)-1,2,4-triazol-3-yl]-2-phenyl-ethanone

Systemtic Name: 1-[5-butyl-1-(3-methyl-5-phenyl-4-pyridin-4-yl-1,2,3,4-tetrazol-2-yl)-1,2,4-triazol-3-yl]-2-phenyl-ethanone Openeye Name: 1-[5-butyl-1-[3-methyl-5-phenyl-4-(4-pyridyl)tetrazol-2-yl]-1,2,4-triazol-3-yl]-2-phenyl-ethanone CAS Name: 1-[5-butyl-1-(3-methyl-5-phenyl-4-pyridin-4-yl-2-tetrazolyl)-1,2,4-triazol-3-yl]-2-phenylethanone IUPAC Name: 1-[5-butyl-1-(3-methyl-5-phenyl-4-pyridin-4-yltetrazol-2-yl)-1,2,4-triazol-3-yl]-2-phenylethanone Traditional Name: 1-[5-butyl-1-[3-methyl-5-phenyl-4-(4-pyridyl)tetrazol-2-yl]-1,2,4-triazol-3-yl]-2-phenyl-ethanone Formula: C27H28N8O MolecularWeight: 480.56422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=NN1N2N=C(N(N2C)C3=CC=NC=C3)C4=CC=CC=C4)C(=O)CC5=CC=CC=C5

Isomeric SMILES

CCCCC1=NC(=NN1N2N=C(N(N2C)C3=CC=NC=C3)C4=CC=CC=C4)C(=O)CC5=CC=CC=C5

InChI

InChI=1S/C27H28N8O/c1-3-4-15-25-29-26(24(36)20-21-11-7-5-8-12-21)30-34(25)35-31-27(22-13-9-6-10-14-22)33(32(35)2)23-16-18-28-19-17-23/h5-14,16-19H,3-4,15,20H2,1-2H3