S-(1-methylimidazol-2-yl) 3-chloranylbenzenecarbothioate

Systemtic Name: S-(1-methylimidazol-2-yl) 3-chloranylbenzenecarbothioate Openeye Name: S-(1-methylimidazol-2-yl) 3-chlorobenzenecarbothioate CAS Name: 3-chlorobenzenecarbothioic acid S-(1-methyl-2-imidazolyl) ester IUPAC Name: S-(1-methylimidazol-2-yl) 3-chlorobenzenecarbothioate Traditional Name: 3-chlorothiobenzoic acid S-(1-methylimidazol-2-yl) ester Formula: C11H9ClN2OS MolecularWeight: 252.71996

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CN1C=CN=C1SC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C11H9ClN2OS/c1-14-6-5-13-11(14)16-10(15)8-3-2-4-9(12)7-8/h2-7H,1H3