5,8-dimethyl-3-(4-methylphenyl)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrimido[5,4-b]indole-2,4-dione

Systemtic Name: 5,8-dimethyl-3-(4-methylphenyl)-1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)pyrimido[5,4-b]indole-2,4-dione Openeye Name: 5,8-dimethyl-1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-3-(p-tolyl)pyrimido[5,4-b]indole-2,4-dione CAS Name: 5,8-dimethyl-3-(4-methylphenyl)-1-[2-oxo-2-(1-pyrrolidinyl)ethyl]pyrimido[5,4-b]indole-2,4-dione IUPAC Name: 5,8-dimethyl-3-(4-methylphenyl)-1-(2-oxo-2-pyrrolidin-1-ylethyl)pyrimido[5,4-b]indole-2,4-dione Traditional Name: 1-(2-keto-2-pyrrolidino-ethyl)-5,8-dimethyl-3-(p-tolyl)pyrimid[5,4-b]indole-2,4-quinone Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)C)N(C2=O)CC(=O)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=C(C4=C(N3C)C=CC(=C4)C)N(C2=O)CC(=O)N5CCCC5

InChI

InChI=1S/C25H26N4O3/c1-16-6-9-18(10-7-16)29-24(31)23-22(19-14-17(2)8-11-20(19)26(23)3)28(25(29)32)15-21(30)27-12-4-5-13-27/h6-11,14H,4-5,12-13,15H2,1-3H3