1-(4-chlorophenyl)-4,6-bis(oxidanylidene)-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate

Systemtic Name: 1-(4-chlorophenyl)-4,6-bis(oxidanylidene)-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate Openeye Name: 1-(4-chlorophenyl)-4,6-dioxo-5,5-bis[2-(4-pyridyl)ethyl]pyrimidin-2-olate CAS Name: 1-(4-chlorophenyl)-4,6-dioxo-5,5-bis(2-pyridin-4-ylethyl)-2-pyrimidinolate IUPAC Name: 1-(4-chlorophenyl)-4,6-dioxo-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate Traditional Name: 1-(4-chlorophenyl)-4,6-diketo-5,5-bis[2-(4-pyridyl)ethyl]pyrimidin-2-olate Formula: C24H20ClN4O3- MolecularWeight: 447.8936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C(C(=O)N=C2[O-])(CCC3=CC=NC=C3)CCC4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C(C(=O)N=C2[O-])(CCC3=CC=NC=C3)CCC4=CC=NC=C4)Cl

InChI

InChI=1S/C24H21ClN4O3/c25-19-1-3-20(4-2-19)29-22(31)24(21(30)28-23(29)32,11-5-17-7-13-26-14-8-17)12-6-18-9-15-27-16-10-18/h1-4,7-10,13-16H,5-6,11-12H2,(H,28,30,32)/p-1