6-methyl-2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]sulfanyl-pyrimidin-4-olate

Systemtic Name: 6-methyl-2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]sulfanyl-pyrimidin-4-olate Openeye Name: 2-[2-(4-anilinoanilino)-2-oxo-ethyl]sulfanyl-6-methyl-pyrimidin-4-olate CAS Name: 2-[[2-(4-anilinoanilino)-2-oxoethyl]thio]-6-methyl-4-pyrimidinolate IUPAC Name: 2-[2-(4-anilinoanilino)-2-oxoethyl]sulfanyl-6-methylpyrimidin-4-olate Traditional Name: 2-[[2-(4-anilinoanilino)-2-keto-ethyl]thio]-6-methyl-pyrimidin-4-olate Formula: C19H17N4O2S- MolecularWeight: 365.42888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3)[O-]

InChI

InChI=1S/C19H18N4O2S/c1-13-11-17(24)23-19(20-13)26-12-18(25)22-16-9-7-15(8-10-16)21-14-5-3-2-4-6-14/h2-11,21H,12H2,1H3,(H,22,25)(H,20,23,24)/p-1