S-tert-butyl 2-chloranylbenzenecarbothioate

Systemtic Name: S-tert-butyl 2-chloranylbenzenecarbothioate Openeye Name: S-tert-butyl 2-chlorobenzenecarbothioate CAS Name: 2-chlorobenzenecarbothioic acid S-tert-butyl ester IUPAC Name: S-tert-butyl 2-chlorobenzenecarbothioate Traditional Name: 2-chlorothiobenzoic acid S-tert-butyl ester Formula: C11H13ClOS MolecularWeight: 228.73832

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SC(=O)C1=CC=CC=C1Cl

Isomeric SMILES

CC(C)(C)SC(=O)C1=CC=CC=C1Cl

InChI

InChI=1S/C11H13ClOS/c1-11(2,3)14-10(13)8-6-4-5-7-9(8)12/h4-7H,1-3H3