1-[(4-ethylphenyl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one

Systemtic Name: 1-[(4-ethylphenyl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Openeye Name: 1-[(4-ethylphenyl)methyl]-4-(4-pyridylmethyl)-1,4-diazepan-5-one CAS Name: 1-[(4-ethylphenyl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one IUPAC Name: 1-[(4-ethylphenyl)methyl]-4-(pyridin-4-ylmethyl)-1,4-diazepan-5-one Traditional Name: 1-(4-ethylbenzyl)-4-(4-pyridylmethyl)-1,4-diazepan-5-one Formula: C20H25N3O MolecularWeight: 323.432

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN2CCC(=O)N(CC2)CC3=CC=NC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)CN2CCC(=O)N(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C20H25N3O/c1-2-17-3-5-18(6-4-17)15-22-12-9-20(24)23(14-13-22)16-19-7-10-21-11-8-19/h3-8,10-11H,2,9,12-16H2,1H3