3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-piperidin-1-yl-pyrido[3,4-d]pyridazine-1,4-dione

Systemtic Name: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-piperidin-1-yl-pyrido[3,4-d]pyridazine-1,4-dione Openeye Name: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-(1-piperidyl)pyrido[3,4-d]pyridazine-1,4-dione CAS Name: 3,7-dimethyl-2-[3-(4-phenyl-1-piperazinyl)propyl]-5-(1-piperidinyl)pyrido[3,4-d]pyridazine-1,4-dione IUPAC Name: 3,7-dimethyl-2-[3-(4-phenylpiperazin-1-yl)propyl]-5-piperidin-1-ylpyrido[3,4-d]pyridazine-1,4-dione Traditional Name: 3,7-dimethyl-2-[3-(4-phenylpiperazino)propyl]-5-piperidino-pyrido[3,4-d]pyridazine-1,4-quinone Formula: C27H36N6O2 MolecularWeight: 476.61374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C2C(=C1)C(=O)N(N(C2=O)C)CCCN3CCN(CC3)C4=CC=CC=C4)N5CCCCC5

Isomeric SMILES

CC1=NC(=C2C(=C1)C(=O)N(N(C2=O)C)CCCN3CCN(CC3)C4=CC=CC=C4)N5CCCCC5

InChI

InChI=1S/C27H36N6O2/c1-21-20-23-24(25(28-21)32-13-7-4-8-14-32)27(35)29(2)33(26(23)34)15-9-12-30-16-18-31(19-17-30)22-10-5-3-6-11-22/h3,5-6,10-11,20H,4,7-9,12-19H2,1-2H3