1-(3-chlorophenyl)-4,6-bis(oxidanylidene)-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate

Systemtic Name: 1-(3-chlorophenyl)-4,6-bis(oxidanylidene)-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate Openeye Name: 1-(3-chlorophenyl)-4,6-dioxo-5,5-bis[2-(4-pyridyl)ethyl]pyrimidin-2-olate CAS Name: 1-(3-chlorophenyl)-4,6-dioxo-5,5-bis(2-pyridin-4-ylethyl)-2-pyrimidinolate IUPAC Name: 1-(3-chlorophenyl)-4,6-dioxo-5,5-bis(2-pyridin-4-ylethyl)pyrimidin-2-olate Traditional Name: 1-(3-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(=C1)Cl)N2C(=O)C(C(=O)N=C2[O-])(CCC3=CC=NC=C3)CCC4=CC=NC=C4

Isomeric SMILES

C1=CC(=CC(=C1)Cl)N2C(=O)C(C(=O)N=C2[O-])(CCC3=CC=NC=C3)CCC4=CC=NC=C4

InChI

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