(5-fluoranyl-1H-indol-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone

Systemtic Name: (5-fluoranyl-1H-indol-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Openeye Name: (5-fluoro-1H-indol-2-yl)-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]methanone CAS Name: (5-fluoro-1H-indol-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone IUPAC Name: (5-fluoro-1H-indol-2-yl)-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]methanone Traditional Name: (5-fluoro-1H-indol-2-yl)-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]methanone Formula: C22H24FN3O MolecularWeight: 365.443863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)C3=CC4=C(N3)C=CC(=C4)F

InChI

InChI=1S/C22H24FN3O/c1-16-3-5-17(6-4-16)15-25-9-2-10-26(12-11-25)22(27)21-14-18-13-19(23)7-8-20(18)24-21/h3-8,13-14,24H,2,9-12,15H2,1H3