2-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-methylamino]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-methylamino]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-methyl-amino]butyl]isoindoline-1,3-quinone Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H28N4O2/c1-18-23(19(2)29(26-18)20-11-5-4-6-12-20)17-27(3)15-9-10-16-28-24(30)21-13-7-8-14-22(21)25(28)31/h4-8,11-14H,9-10,15-17H2,1-3H3