4-[6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[6-(p-tolyl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[6-(4-methylphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[6-(p-tolyl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H14N2OS MolecularWeight: 294.37086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=S)N2

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=S)N2

InChI

InChI=1S/C17H14N2OS/c1-11-2-4-12(5-3-11)15-10-16(19-17(21)18-15)13-6-8-14(20)9-7-13/h2-10H,1H3,(H2,18,19,21)