3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]isoxazole CAS Name: 3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[[4-[(5-phenyl-1H-pyrazol-4-yl)methyl]-1,4-diazepan-1-yl]methyl]isoxazole Formula: C21H27N5O MolecularWeight: 365.47198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CN2CCCN(CC2)CC3=C(NN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NO1)C)CN2CCCN(CC2)CC3=C(NN=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H27N5O/c1-16-20(17(2)27-24-16)15-26-10-6-9-25(11-12-26)14-19-13-22-23-21(19)18-7-4-3-5-8-18/h3-5,7-8,13H,6,9-12,14-15H2,1-2H3,(H,22,23)