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

Systemtic Name: 1-[(5-methylpyridin-2-yl)-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Openeye Name: 1-[(5-methyl-2-pyridyl)-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane CAS Name: 1-[(5-methyl-2-pyridinyl)-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane IUPAC Name: 1-[(5-methylpyridin-2-yl)-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Traditional Name: 1-[(5-methyl-2-pyridyl)-[4-(trifluoromethyl)phenyl]methyl]-1,4-diazepane Formula: C19H22F3N3 MolecularWeight: 349.39329

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)N3CCCNCC3

Isomeric SMILES

CC1=CN=C(C=C1)C(C2=CC=C(C=C2)C(F)(F)F)N3CCCNCC3

InChI

InChI=1S/C19H22F3N3/c1-14-3-8-17(24-13-14)18(25-11-2-9-23-10-12-25)15-4-6-16(7-5-15)19(20,21)22/h3-8,13,18,23H,2,9-12H2,1H3