3-(4-methoxyphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-4-olate

Systemtic Name: 3-(4-methoxyphenyl)-2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-oxidanylidene-5-(phenylmethyl)pyrimidin-4-olate Openeye Name: 5-benzyl-3-(4-methoxyphenyl)-2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanyl-6-oxo-pyrimidin-4-olate CAS Name: 3-(4-methoxyphenyl)-2-[[2-(4-methylanilino)-2-oxoethyl]thio]-6-oxo-5-(phenylmethyl)-4-pyrimidinolate IUPAC Name: 5-benzyl-3-(4-methoxyphenyl)-2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-6-oxopyrimidin-4-olate Traditional Name: 5-benzyl-6-keto-2-[[2-keto-2-(p-toluidino)ethyl]thio]-3-(4-methoxyphenyl)pyrimidin-4-olate Formula: C27H24N3O4S- MolecularWeight: 486.56216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)OC)[O-])CC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=NC(=O)C(=C(N2C3=CC=C(C=C3)OC)[O-])CC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O4S/c1-18-8-10-20(11-9-18)28-24(31)17-35-27-29-25(32)23(16-19-6-4-3-5-7-19)26(33)30(27)21-12-14-22(34-2)15-13-21/h3-15,33H,16-17H2,1-2H3,(H,28,31)/p-1