3-(4-methoxyphenyl)-6-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-5-(phenylmethyl)pyrimidin-4-olate

Systemtic Name: 3-(4-methoxyphenyl)-6-oxidanylidene-2-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-5-(phenylmethyl)pyrimidin-4-olate Openeye Name: 2-(2-anilino-2-oxo-ethyl)sulfanyl-5-benzyl-3-(4-methoxyphenyl)-6-oxo-pyrimidin-4-olate CAS Name: 2-[(2-anilino-2-oxoethyl)thio]-3-(4-methoxyphenyl)-6-oxo-5-(phenylmethyl)-4-pyrimidinolate IUPAC Name: 2-(2-anilino-2-oxoethyl)sulfanyl-5-benzyl-3-(4-methoxyphenyl)-6-oxopyrimidin-4-olate Traditional Name: 2-[(2-anilino-2-keto-ethyl)thio]-5-benzyl-6-keto-3-(4-methoxyphenyl)pyrimidin-4-olate Formula: C26H22N3O4S- MolecularWeight: 472.53558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)NC3=CC=CC=C3)CC4=CC=CC=C4)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=C(C(=O)N=C2SCC(=O)NC3=CC=CC=C3)CC4=CC=CC=C4)[O-]

InChI

InChI=1S/C26H23N3O4S/c1-33-21-14-12-20(13-15-21)29-25(32)22(16-18-8-4-2-5-9-18)24(31)28-26(29)34-17-23(30)27-19-10-6-3-7-11-19/h2-15,32H,16-17H2,1H3,(H,27,30)/p-1