3-(2,4-dimethylphenyl)-6-oxidanylidene-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidene-pyrimidin-4-olate

Systemtic Name: 3-(2,4-dimethylphenyl)-6-oxidanylidene-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidene-pyrimidin-4-olate Openeye Name: 3-(2,4-dimethylphenyl)-6-oxo-5-(pyrrol-2-ylidenemethyl)-2-thioxo-pyrimidin-4-olate CAS Name: 3-(2,4-dimethylphenyl)-6-oxo-5-(2-pyrrolylidenemethyl)-2-sulfanylidene-4-pyrimidinolate IUPAC Name: 3-(2,4-dimethylphenyl)-6-oxo-5-(pyrrol-2-ylidenemethyl)-2-sulfanylidenepyrimidin-4-olate Traditional Name: 3-(2,4-dimethylphenyl)-6-keto-5-(pyrrol-2-ylidenemethyl)-2-thioxo-pyrimidin-4-olate Formula: C17H14N3O2S- MolecularWeight: 324.37696

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3C=CC=N3)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C(=O)NC2=S)C=C3C=CC=N3)[O-])C

InChI

InChI=1S/C17H15N3O2S/c1-10-5-6-14(11(2)8-10)20-16(22)13(15(21)19-17(20)23)9-12-4-3-7-18-12/h3-9,22H,1-2H3,(H,19,21,23)/p-1