N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide

Systemtic Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide Openeye Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methyl-propanamide CAS Name: N-[[(4,6-dimethoxy-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-methylpropanamide IUPAC Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)carbamothioyl]-2-methylpropanamide Traditional Name: N-[(4,6-dimethoxy-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-methyl-propionamide Formula: C14H17N3O3S2 MolecularWeight: 339.43308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC(=S)NC1=NC2=C(C=C(C=C2S1)OC)OC

Isomeric SMILES

CC(C)C(=O)NC(=S)NC1=NC2=C(C=C(C=C2S1)OC)OC

InChI

InChI=1S/C14H17N3O3S2/c1-7(2)12(18)16-13(21)17-14-15-11-9(20-4)5-8(19-3)6-10(11)22-14/h5-7H,1-4H3,(H2,15,16,17,18,21)