1-[5-(4-chlorophenyl)-7-(4-methylphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione

Systemtic Name: 1-[5-(4-chlorophenyl)-7-(4-methylphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione Openeye Name: 1-[5-(4-chlorophenyl)-7-(p-tolyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione CAS Name: 1-[5-(4-chlorophenyl)-7-(4-methylphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione IUPAC Name: 1-[5-(4-chlorophenyl)-7-(4-methylphenyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-dione Traditional Name: 1-[5-(4-chlorophenyl)-7-(p-tolyl)-1,5,6,7-tetrahydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]pyrrolidine-2,5-quinone Formula: C22H20ClN5O2 MolecularWeight: 421.8795

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(N=C3N2NC(=N3)N4C(=O)CCC4=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(N=C3N2NC(=N3)N4C(=O)CCC4=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C22H20ClN5O2/c1-13-2-4-15(5-3-13)18-12-17(14-6-8-16(23)9-7-14)24-21-25-22(26-28(18)21)27-19(29)10-11-20(27)30/h2-9,17-18H,10-12H2,1H3,(H,24,25,26)