S-(6-oxidanylidene-1H-pyrimidin-2-yl) 4-chloranylbenzenecarbothioate

Systemtic Name: S-(6-oxidanylidene-1H-pyrimidin-2-yl) 4-chloranylbenzenecarbothioate Openeye Name: S-(6-oxo-1H-pyrimidin-2-yl) 4-chlorobenzenecarbothioate CAS Name: 4-chlorobenzenecarbothioic acid S-(6-oxo-1H-pyrimidin-2-yl) ester IUPAC Name: S-(6-oxo-1H-pyrimidin-2-yl) 4-chlorobenzenecarbothioate Traditional Name: 4-chlorothiobenzoic acid S-(6-keto-1H-pyrimidin-2-yl) ester Formula: C11H7ClN2O2S MolecularWeight: 266.70348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)SC2=NC=CC(=O)N2)Cl

Isomeric SMILES

C1=CC(=CC=C1C(=O)SC2=NC=CC(=O)N2)Cl

InChI

InChI=1S/C11H7ClN2O2S/c12-8-3-1-7(2-4-8)10(16)17-11-13-6-5-9(15)14-11/h1-6H,(H,13,14,15)