2-(1,3-benzothiazol-2-yl)-2-methyl-butanebis(thioic S-acid)

Systemtic Name: 2-(1,3-benzothiazol-2-yl)-2-methyl-butanebis(thioic S-acid) Openeye Name: 2-(1,3-benzothiazol-2-yl)-2-methyl-butanebis(thioic S-acid) CAS Name: 2-(1,3-benzothiazol-2-yl)-2-methylbutanebis(thioic S-acid) IUPAC Name: 2-(1,3-benzothiazol-2-yl)-2-methylbutanebis(thioic S-acid) Traditional Name: 2-(1,3-benzothiazol-2-yl)-2-methyl-butanebis(thioic S-acid) Formula: C12H11NO2S3 MolecularWeight: 297.41624

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)S)(C1=NC2=CC=CC=C2S1)C(=O)S

Isomeric SMILES

CC(CC(=O)S)(C1=NC2=CC=CC=C2S1)C(=O)S

InChI

InChI=1S/C12H11NO2S3/c1-12(11(15)17,6-9(14)16)10-13-7-4-2-3-5-8(7)18-10/h2-5H,6H2,1H3,(H,14,16)(H,15,17)