[1,5-dimethyl-2-(2-methylphenyl)indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone

Systemtic Name: [1,5-dimethyl-2-(2-methylphenyl)indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Openeye Name: [1,5-dimethyl-2-(o-tolyl)indol-3-yl]-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone CAS Name: [1,5-dimethyl-2-(2-methylphenyl)-3-indolyl]-[4-(2-pyridinyl)-1,4-diazepan-1-yl]methanone IUPAC Name: [1,5-dimethyl-2-(2-methylphenyl)indol-3-yl]-(4-pyridin-2-yl-1,4-diazepan-1-yl)methanone Traditional Name: [1,5-dimethyl-2-(o-tolyl)indol-3-yl]-[4-(2-pyridyl)-1,4-diazepan-1-yl]methanone Formula: C28H30N4O MolecularWeight: 438.564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCCN(CC3)C4=CC=CC=N4)C5=CC=CC=C5C)C

InChI

InChI=1S/C28H30N4O/c1-20-12-13-24-23(19-20)26(27(30(24)3)22-10-5-4-9-21(22)2)28(33)32-16-8-15-31(17-18-32)25-11-6-7-14-29-25/h4-7,9-14,19H,8,15-18H2,1-3H3