3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-4-olate

Systemtic Name: 3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxidanylidene-ethyl)sulfanyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-4-olate Openeye Name: 5-benzyl-2-(2-morpholino-2-oxo-ethyl)sulfanyl-3-(o-tolyl)-6-oxo-pyrimidin-4-olate CAS Name: 3-(2-methylphenyl)-2-[[2-(4-morpholinyl)-2-oxoethyl]thio]-6-oxo-5-(phenylmethyl)-4-pyrimidinolate IUPAC Name: 5-benzyl-3-(2-methylphenyl)-2-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 5-benzyl-6-keto-2-[(2-keto-2-morpholino-ethyl)thio]-3-(o-tolyl)pyrimidin-4-olate Formula: C24H24N3O4S- MolecularWeight: 450.53006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=C(C(=O)N=C2SCC(=O)N3CCOCC3)CC4=CC=CC=C4)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2C(=C(C(=O)N=C2SCC(=O)N3CCOCC3)CC4=CC=CC=C4)[O-]

InChI

InChI=1S/C24H25N3O4S/c1-17-7-5-6-10-20(17)27-23(30)19(15-18-8-3-2-4-9-18)22(29)25-24(27)32-16-21(28)26-11-13-31-14-12-26/h2-10,30H,11-16H2,1H3/p-1