2-(1,3-benzothiazol-2-ylsulfanyl)-5-(2-methylphenyl)benzene-1,4-diol

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-(2-methylphenyl)benzene-1,4-diol Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-(o-tolyl)benzene-1,4-diol CAS Name: 2-(1,3-benzothiazol-2-ylthio)-5-(2-methylphenyl)benzene-1,4-diol IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-5-(2-methylphenyl)benzene-1,4-diol Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-5-(o-tolyl)hydroquinone Formula: C20H15NO2S2 MolecularWeight: 365.4686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=CC(=C(C=C2O)SC3=NC4=CC=CC=C4S3)O

Isomeric SMILES

CC1=CC=CC=C1C2=CC(=C(C=C2O)SC3=NC4=CC=CC=C4S3)O

InChI

InChI=1S/C20H15NO2S2/c1-12-6-2-3-7-13(12)14-10-17(23)19(11-16(14)22)25-20-21-15-8-4-5-9-18(15)24-20/h2-11,22-23H,1H3