[2-(5-bromanyl-1H-indol-3-yl)-6,7-dimethyl-quinolin-4-yl]-(1,4-diazepan-1-yl)methanone

Systemtic Name: [2-(5-bromanyl-1H-indol-3-yl)-6,7-dimethyl-quinolin-4-yl]-(1,4-diazepan-1-yl)methanone Openeye Name: [2-(5-bromo-1H-indol-3-yl)-6,7-dimethyl-4-quinolyl]-(1,4-diazepan-1-yl)methanone CAS Name: [2-(5-bromo-1H-indol-3-yl)-6,7-dimethyl-4-quinolinyl]-(1,4-diazepan-1-yl)methanone IUPAC Name: [2-(5-bromo-1H-indol-3-yl)-6,7-dimethylquinolin-4-yl]-(1,4-diazepan-1-yl)methanone Traditional Name: [2-(5-bromo-1H-indol-3-yl)-6,7-dimethyl-4-quinolyl]-(1,4-diazepan-1-yl)methanone Formula: C25H25BrN4O MolecularWeight: 477.3962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=N2)C3=CNC4=C3C=C(C=C4)Br)C(=O)N5CCCNCC5)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=N2)C3=CNC4=C3C=C(C=C4)Br)C(=O)N5CCCNCC5)C

InChI

InChI=1S/C25H25BrN4O/c1-15-10-18-20(25(31)30-8-3-6-27-7-9-30)13-24(29-23(18)11-16(15)2)21-14-28-22-5-4-17(26)12-19(21)22/h4-5,10-14,27-28H,3,6-9H2,1-2H3