5,7-dimethyl-6-[4-oxidanylidene-4-(4-propylpiperazin-1-yl)butyl]-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one

Systemtic Name: 5,7-dimethyl-6-[4-oxidanylidene-4-(4-propylpiperazin-1-yl)butyl]-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one Openeye Name: 5,7-dimethyl-6-[4-oxo-4-(4-propylpiperazin-1-yl)butyl]-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one CAS Name: 5,7-dimethyl-6-[4-oxo-4-(4-propyl-1-piperazinyl)butyl]-3-phenyl-4-pyrrolo[3,4-d]pyridazinone IUPAC Name: 5,7-dimethyl-6-[4-oxo-4-(4-propylpiperazin-1-yl)butyl]-3-phenylpyrrolo[3,4-d]pyridazin-4-one Traditional Name: 6-[4-keto-4-(4-propylpiperazino)butyl]-5,7-dimethyl-3-phenyl-pyrrolo[3,4-d]pyridazin-4-one Formula: C25H33N5O2 MolecularWeight: 435.56182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)C(=O)CCCN2C(=C3C=NN(C(=O)C3=C2C)C4=CC=CC=C4)C

Isomeric SMILES

CCCN1CCN(CC1)C(=O)CCCN2C(=C3C=NN(C(=O)C3=C2C)C4=CC=CC=C4)C

InChI

InChI=1S/C25H33N5O2/c1-4-12-27-14-16-28(17-15-27)23(31)11-8-13-29-19(2)22-18-26-30(21-9-6-5-7-10-21)25(32)24(22)20(29)3/h5-7,9-10,18H,4,8,11-17H2,1-3H3