1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-methyl-2-pyridyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-methyl-2-pyridinyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-methylpyridin-2-yl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-methyl-2-pyridyl)-(3-phenoxyphenyl)methyl]-1,4-diazepane Formula: C24H27N3O MolecularWeight: 373.49068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCNCC4

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC(=CC=C2)OC3=CC=CC=C3)N4CCCNCC4

InChI

InChI=1S/C24H27N3O/c1-19-11-12-23(26-18-19)24(27-15-6-13-25-14-16-27)20-7-5-10-22(17-20)28-21-8-3-2-4-9-21/h2-5,7-12,17-18,24-25H,6,13-16H2,1H3