4,6-dimethyl-5-pyridin-3-yl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyrrole-1,3-dione

Systemtic Name: 4,6-dimethyl-5-pyridin-3-yl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyrrole-1,3-dione Openeye Name: 4,6-dimethyl-5-(3-pyridyl)-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyrrole-1,3-dione CAS Name: 4,6-dimethyl-5-(3-pyridinyl)-2-[4-[4-(2-pyrimidinyl)-1-piperazinyl]butyl]pyrrolo[3,4-c]pyrrole-1,3-dione IUPAC Name: 4,6-dimethyl-5-pyridin-3-yl-2-[4-(4-pyrimidin-2-ylpiperazin-1-yl)butyl]pyrrolo[3,4-c]pyrrole-1,3-dione Traditional Name: 4,6-dimethyl-5-(3-pyridyl)-2-[4-[4-(2-pyrimidyl)piperazino]butyl]pyrrolo[3,4-c]pyrrole-1,3-quinone Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(N1C3=CN=CC=C3)C)C(=O)N(C2=O)CCCCN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C2C(=C(N1C3=CN=CC=C3)C)C(=O)N(C2=O)CCCCN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H29N7O2/c1-18-21-22(19(2)32(18)20-7-5-8-26-17-20)24(34)31(23(21)33)12-4-3-11-29-13-15-30(16-14-29)25-27-9-6-10-28-25/h5-10,17H,3-4,11-16H2,1-2H3