2-[(4-chlorophenyl)methylsulfanyl]-6-oxidanylidene-3-prop-2-enyl-pyrimidin-4-olate

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-oxidanylidene-3-prop-2-enyl-pyrimidin-4-olate Openeye Name: 3-allyl-2-[(4-chlorophenyl)methylsulfanyl]-6-oxo-pyrimidin-4-olate CAS Name: 2-[(4-chlorophenyl)methylthio]-6-oxo-3-prop-2-enyl-4-pyrimidinolate IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-6-oxo-3-prop-2-enylpyrimidin-4-olate Traditional Name: 3-allyl-2-[(4-chlorobenzyl)thio]-6-keto-pyrimidin-4-olate Formula: C14H12ClN2O2S- MolecularWeight: 307.77528

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=CC(=O)N=C1SCC2=CC=C(C=C2)Cl)[O-]

Isomeric SMILES

C=CCN1C(=CC(=O)N=C1SCC2=CC=C(C=C2)Cl)[O-]

InChI

InChI=1S/C14H13ClN2O2S/c1-2-7-17-13(19)8-12(18)16-14(17)20-9-10-3-5-11(15)6-4-10/h2-6,8,19H,1,7,9H2/p-1