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

Systemtic Name: 2-[2-oxidanylidene-2-[(4-propan-2-ylphenyl)amino]ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-(4-isopropylanilino)-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-oxo-2-(4-propan-2-ylanilino)ethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-oxo-2-(4-propan-2-ylanilino)ethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[(2-cumidino-2-keto-ethyl)thio]pyrimidin-4-olate Formula: C15H16N3O2S- MolecularWeight: 302.37144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17N3O2S/c1-10(2)11-3-5-12(6-4-11)17-14(20)9-21-15-16-8-7-13(19)18-15/h3-8,10H,9H2,1-2H3,(H,17,20)(H,16,18,19)/p-1