1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(pyridin-3-ylmethyl)-1,4-diazepane

Systemtic Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(pyridin-3-ylmethyl)-1,4-diazepane Openeye Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(3-pyridylmethyl)-1,4-diazepane CAS Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(3-pyridinylmethyl)-1,4-diazepane IUPAC Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(pyridin-3-ylmethyl)-1,4-diazepane Traditional Name: 1-[(2-ethyl-5-methyl-1H-imidazol-4-yl)methyl]-4-(3-pyridylmethyl)-1,4-diazepane Formula: C18H27N5 MolecularWeight: 313.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=C(N1)C)CN2CCCN(CC2)CC3=CN=CC=C3

Isomeric SMILES

CCC1=NC(=C(N1)C)CN2CCCN(CC2)CC3=CN=CC=C3

InChI

InChI=1S/C18H27N5/c1-3-18-20-15(2)17(21-18)14-23-9-5-8-22(10-11-23)13-16-6-4-7-19-12-16/h4,6-7,12H,3,5,8-11,13-14H2,1-2H3,(H,20,21)