3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole

Systemtic Name: 3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Openeye Name: 3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole CAS Name: 3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole IUPAC Name: 3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Traditional Name: 3-[[4-(1H-imidazol-2-ylmethyl)-1,4-diazepan-1-yl]methyl]-5-phenyl-1,2,4-oxadiazole Formula: C18H22N6O MolecularWeight: 338.40688

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)CC2=NOC(=N2)C3=CC=CC=C3)CC4=NC=CN4

Isomeric SMILES

C1CN(CCN(C1)CC2=NOC(=N2)C3=CC=CC=C3)CC4=NC=CN4

InChI

InChI=1S/C18H22N6O/c1-2-5-15(6-3-1)18-21-17(22-25-18)14-24-10-4-9-23(11-12-24)13-16-19-7-8-20-16/h1-3,5-8H,4,9-14H2,(H,19,20)