1-[(5-ethylpyridin-2-yl)-(2-methylphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-ethylpyridin-2-yl)-(2-methylphenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-ethyl-2-pyridyl)-(o-tolyl)methyl]-1,4-diazepane CAS Name: 1-[(5-ethyl-2-pyridinyl)-(2-methylphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-ethylpyridin-2-yl)-(2-methylphenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-ethyl-2-pyridyl)-(o-tolyl)methyl]-1,4-diazepane Formula: C20H27N3 MolecularWeight: 309.44848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(C=C1)C(C2=CC=CC=C2C)N3CCCNCC3

Isomeric SMILES

CCC1=CN=C(C=C1)C(C2=CC=CC=C2C)N3CCCNCC3

InChI

InChI=1S/C20H27N3/c1-3-17-9-10-19(22-15-17)20(18-8-5-4-7-16(18)2)23-13-6-11-21-12-14-23/h4-5,7-10,15,20-21H,3,6,11-14H2,1-2H3