(1,5-dimethyl-2-phenyl-indol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone dihydrochloride

Systemtic Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone dihydrochloride Openeye Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(3-pyridyl)piperazin-1-yl]methanone dihydrochloride CAS Name: (1,5-dimethyl-2-phenyl-3-indolyl)-[4-(3-pyridinyl)-1-piperazinyl]methanone dihydrochloride IUPAC Name: (1,5-dimethyl-2-phenylindol-3-yl)-(4-pyridin-3-ylpiperazin-1-yl)methanone dihydrochloride Traditional Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(3-pyridyl)piperazino]methanone dihydrochloride Formula: C26H28Cl2N4O MolecularWeight: 483.43272

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCN(CC3)C4=CN=CC=C4)C5=CC=CC=C5)C.Cl.Cl

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCN(CC3)C4=CN=CC=C4)C5=CC=CC=C5)C.Cl.Cl

InChI

InChI=1S/C26H26N4O.2ClH/c1-19-10-11-23-22(17-19)24(25(28(23)2)20-7-4-3-5-8-20)26(31)30-15-13-29(14-16-30)21-9-6-12-27-18-21;;/h3-12,17-18H,13-16H2,1-2H3;2*1H