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

Systemtic Name: 1-[(4-ethylphenyl)-(5-methylpyridin-2-yl)methyl]-1,4-diazepane Openeye Name: 1-[(4-ethylphenyl)-(5-methyl-2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(4-ethylphenyl)-(5-methyl-2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(4-ethylphenyl)-(5-methylpyridin-2-yl)methyl]-1,4-diazepane Traditional Name: 1-[(4-ethylphenyl)-(5-methyl-2-pyridyl)methyl]-1,4-diazepane Formula: C20H27N3 MolecularWeight: 309.44848

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=NC=C(C=C2)C)N3CCCNCC3

Isomeric SMILES

CCC1=CC=C(C=C1)C(C2=NC=C(C=C2)C)N3CCCNCC3

InChI

InChI=1S/C20H27N3/c1-3-17-6-8-18(9-7-17)20(19-10-5-16(2)15-22-19)23-13-4-11-21-12-14-23/h5-10,15,20-21H,3-4,11-14H2,1-2H3