(2-chloranyl-6-fluoranyl-3-methyl-phenyl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone

Systemtic Name: (2-chloranyl-6-fluoranyl-3-methyl-phenyl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Openeye Name: (2-chloro-6-fluoro-3-methyl-phenyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (2-chloro-6-fluoro-3-methylphenyl)-[4-(2-pyridinylmethyl)-1,4-diazepan-1-yl]methanone IUPAC Name: (2-chloro-6-fluoro-3-methylphenyl)-[4-(pyridin-2-ylmethyl)-1,4-diazepan-1-yl]methanone Traditional Name: (2-chloro-6-fluoro-3-methyl-phenyl)-[4-(2-pyridylmethyl)-1,4-diazepan-1-yl]methanone Formula: C19H21ClFN3O MolecularWeight: 361.840943

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)F)C(=O)N2CCCN(CC2)CC3=CC=CC=N3)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)F)C(=O)N2CCCN(CC2)CC3=CC=CC=N3)Cl

InChI

InChI=1S/C19H21ClFN3O/c1-14-6-7-16(21)17(18(14)20)19(25)24-10-4-9-23(11-12-24)13-15-5-2-3-8-22-15/h2-3,5-8H,4,9-13H2,1H3