2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]pyrimidin-4-olate

Systemtic Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]pyrimidin-4-olate Openeye Name: 6-[2-(4-isopropylanilino)-2-oxo-ethyl]-2-[(3-methoxyphenyl)methylsulfanyl]pyrimidin-4-olate CAS Name: 2-[(3-methoxyphenyl)methylthio]-6-[2-oxo-2-(4-propan-2-ylanilino)ethyl]-4-pyrimidinolate IUPAC Name: 2-[(3-methoxyphenyl)methylsulfanyl]-6-[2-oxo-2-(4-propan-2-ylanilino)ethyl]pyrimidin-4-olate Traditional Name: 6-(2-cumidino-2-keto-ethyl)-2-(m-anisylthio)pyrimidin-4-olate Formula: C23H24N3O3S- MolecularWeight: 422.51996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)CC2=CC(=NC(=N2)SCC3=CC(=CC=C3)OC)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)CC2=CC(=NC(=N2)SCC3=CC(=CC=C3)OC)[O-]

InChI

InChI=1S/C23H25N3O3S/c1-15(2)17-7-9-18(10-8-17)24-21(27)12-19-13-22(28)26-23(25-19)30-14-16-5-4-6-20(11-16)29-3/h4-11,13,15H,12,14H2,1-3H3,(H,24,27)(H,25,26,28)/p-1