2-[2-[(2-methoxy-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate

Systemtic Name: 2-[2-[(2-methoxy-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanylpyrimidin-4-olate Openeye Name: 2-[2-(2-methoxy-4-methyl-anilino)-2-oxo-ethyl]sulfanylpyrimidin-4-olate CAS Name: 2-[[2-(2-methoxy-4-methylanilino)-2-oxoethyl]thio]-4-pyrimidinolate IUPAC Name: 2-[2-(2-methoxy-4-methylanilino)-2-oxoethyl]sulfanylpyrimidin-4-olate Traditional Name: 2-[[2-keto-2-(2-methoxy-4-methyl-anilino)ethyl]thio]pyrimidin-4-olate Formula: C14H14N3O3S- MolecularWeight: 304.34426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=N2)[O-])OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSC2=NC=CC(=N2)[O-])OC

InChI

InChI=1S/C14H15N3O3S/c1-9-3-4-10(11(7-9)20-2)16-13(19)8-21-14-15-6-5-12(18)17-14/h3-7H,8H2,1-2H3,(H,16,19)(H,15,17,18)/p-1