1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[5-methyl-2-(2-pyridinyl)-1H-indol-3-yl]-1-butanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-(5-methyl-2-pyridin-2-yl-1H-indol-3-yl)butan-1-one Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-4-[5-methyl-2-(2-pyridyl)-1H-indol-3-yl]butan-1-one Formula: C27H27N3O MolecularWeight: 409.52278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCC4=CC=CC=C4C3)C5=CC=CC=N5

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C2CCCC(=O)N3CCC4=CC=CC=C4C3)C5=CC=CC=N5

InChI

InChI=1S/C27H27N3O/c1-19-12-13-24-23(17-19)22(27(29-24)25-10-4-5-15-28-25)9-6-11-26(31)30-16-14-20-7-2-3-8-21(20)18-30/h2-5,7-8,10,12-13,15,17,29H,6,9,11,14,16,18H2,1H3