2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-oxidanylidene-2-[(4-phenylazanylphenyl)amino]ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-(4-anilinoanilino)-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-(4-anilinoanilino)-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-(4-anilinoanilino)-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-(4-anilinoanilino)-2-keto-ethyl]thio]pyrimidin-4-olate Formula: C18H15N4O2S- MolecularWeight: 351.4023

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CSC3=NC=CC(=N3)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=CC=C(C=C2)NC(=O)CSC3=NC=CC(=N3)[O-]

InChI

InChI=1S/C18H16N4O2S/c23-16-10-11-19-18(22-16)25-12-17(24)21-15-8-6-14(7-9-15)20-13-4-2-1-3-5-13/h1-11,20H,12H2,(H,21,24)(H,19,22,23)/p-1