1-(4-methyl-1-pyridin-2-yl-6,7-dihydro-5H-1,4-diazepin-2-yl)propan-1-one

Systemtic Name: 1-(4-methyl-1-pyridin-2-yl-6,7-dihydro-5H-1,4-diazepin-2-yl)propan-1-one Openeye Name: 1-[4-methyl-1-(2-pyridyl)-6,7-dihydro-5H-1,4-diazepin-2-yl]propan-1-one CAS Name: 1-[4-methyl-1-(2-pyridinyl)-6,7-dihydro-5H-1,4-diazepin-2-yl]-1-propanone IUPAC Name: 1-(4-methyl-1-pyridin-2-yl-6,7-dihydro-5H-1,4-diazepin-2-yl)propan-1-one Traditional Name: 1-[4-methyl-1-(2-pyridyl)-6,7-dihydro-5H-1,4-diazepin-2-yl]propan-1-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CN(CCCN1C2=CC=CC=N2)C

Isomeric SMILES

CCC(=O)C1=CN(CCCN1C2=CC=CC=N2)C

InChI

InChI=1S/C14H19N3O/c1-3-13(18)12-11-16(2)9-6-10-17(12)14-7-4-5-8-15-14/h4-5,7-8,11H,3,6,9-10H2,1-2H3