5-(phenylsulfonyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-(phenylsulfonyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 3-allyl-5-(benzenesulfonyl)-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-(benzenesulfonyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-(benzenesulfonyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 3-allyl-5-besyl-2-thioxo-1H-pyrimidin-4-one Formula: C13H12N2O3S2 MolecularWeight: 308.37598

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CNC1=S)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C=CCN1C(=O)C(=CNC1=S)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H12N2O3S2/c1-2-8-15-12(16)11(9-14-13(15)19)20(17,18)10-6-4-3-5-7-10/h2-7,9H,1,8H2,(H,14,19)