S-[3,7,8-tris(chloranyl)thianthren-2-yl] benzenecarbothioate

Systemtic Name: S-[3,7,8-tris(chloranyl)thianthren-2-yl] benzenecarbothioate Openeye Name: S-(3,7,8-trichlorothianthren-2-yl) benzenecarbothioate CAS Name: benzenecarbothioic acid S-(3,7,8-trichloro-2-thianthrenyl) ester IUPAC Name: S-(3,7,8-trichlorothianthren-2-yl) benzenecarbothioate Traditional Name: thiobenzoic acid S-(3,7,8-trichlorothianthren-2-yl) ester Formula: C19H9Cl3OS3 MolecularWeight: 455.82816

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=C(C=C3C(=C2)SC4=CC(=C(C=C4S3)Cl)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=C(C=C3C(=C2)SC4=CC(=C(C=C4S3)Cl)Cl)Cl

InChI

InChI=1S/C19H9Cl3OS3/c20-11-6-15-16(7-12(11)21)25-18-9-14(13(22)8-17(18)24-15)26-19(23)10-4-2-1-3-5-10/h1-9H