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

Systemtic Name: 4-[6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[6-(4-methoxyphenyl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[6-(4-methoxyphenyl)-2-sulfanylidene-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[6-(4-methoxyphenyl)-2-thioxo-1H-pyrimidin-4-ylidene]cyclohexa-2,5-dien-1-one Formula: C17H14N2O2S MolecularWeight: 310.37026

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=S)N2

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=C3C=CC(=O)C=C3)NC(=S)N2

InChI

InChI=1S/C17H14N2O2S/c1-21-14-8-4-12(5-9-14)16-10-15(18-17(22)19-16)11-2-6-13(20)7-3-11/h2-10H,1H3,(H2,18,19,22)