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

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-6-oxidanylidene-pyrimidin-4-olate Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-6-oxo-pyrimidin-4-olate CAS Name: 2-[(4-chlorophenyl)methylthio]-3-ethyl-6-oxo-4-pyrimidinolate IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-ethyl-6-oxopyrimidin-4-olate Traditional Name: 2-[(4-chlorobenzyl)thio]-3-ethyl-6-keto-pyrimidin-4-olate Formula: C13H12ClN2O2S- MolecularWeight: 295.76458

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13ClN2O2S/c1-2-16-12(18)7-11(17)15-13(16)19-8-9-3-5-10(14)6-4-9/h3-7,18H,2,8H2,1H3/p-1