2-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate

Systemtic Name: 2-[2-[(4-dimethylaminophenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate Openeye Name: 2-[2-[4-(dimethylamino)anilino]-2-oxo-ethyl]sulfanyl-6-phenyl-pyrimidin-4-olate CAS Name: 2-[[2-[4-(dimethylamino)anilino]-2-oxoethyl]thio]-6-phenyl-4-pyrimidinolate IUPAC Name: 2-[2-[4-(dimethylamino)anilino]-2-oxoethyl]sulfanyl-6-phenylpyrimidin-4-olate Traditional Name: 2-[[2-[4-(dimethylamino)anilino]-2-keto-ethyl]thio]-6-phenyl-pyrimidin-4-olate Formula: C20H19N4O2S- MolecularWeight: 379.45546

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)CSC2=NC(=CC(=N2)[O-])C3=CC=CC=C3

InChI

InChI=1S/C20H20N4O2S/c1-24(2)16-10-8-15(9-11-16)21-19(26)13-27-20-22-17(12-18(25)23-20)14-6-4-3-5-7-14/h3-12H,13H2,1-2H3,(H,21,26)(H,22,23,25)/p-1