5-[[4-(2-methylphenyl)-1,4-diazepan-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(2-methylphenyl)-1,4-diazepan-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-(o-tolyl)-1,4-diazepan-1-yl]methyl]-3-(2-pyridyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(2-methylphenyl)-1,4-diazepan-1-yl]methyl]-3-(2-pyridinyl)-1,2,4-oxadiazole IUPAC Name: 5-[[4-(2-methylphenyl)-1,4-diazepan-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[4-(o-tolyl)-1,4-diazepan-1-yl]methyl]-3-(2-pyridyl)-1,2,4-oxadiazole Formula: C20H23N5O MolecularWeight: 349.42952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCCN(CC2)CC3=NC(=NO3)C4=CC=CC=N4

Isomeric SMILES

CC1=CC=CC=C1N2CCCN(CC2)CC3=NC(=NO3)C4=CC=CC=N4

InChI

InChI=1S/C20H23N5O/c1-16-7-2-3-9-18(16)25-12-6-11-24(13-14-25)15-19-22-20(23-26-19)17-8-4-5-10-21-17/h2-5,7-10H,6,11-15H2,1H3