N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,2-dimethyl-propanamide Openeye Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]carbamothioyl]-2,2-dimethyl-propanamide CAS Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methylanilino]-sulfanylidenemethyl]-2,2-dimethylpropanamide IUPAC Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methylphenyl]carbamothioyl]-2,2-dimethylpropanamide Traditional Name: N-[[5-(1,3-benzothiazol-2-yl)-2-methyl-phenyl]thiocarbamoyl]-2,2-dimethyl-propionamide Formula: C20H21N3OS2 MolecularWeight: 383.53024

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C(C)(C)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=S)NC(=O)C(C)(C)C

InChI

InChI=1S/C20H21N3OS2/c1-12-9-10-13(17-21-14-7-5-6-8-16(14)26-17)11-15(12)22-19(25)23-18(24)20(2,3)4/h5-11H,1-4H3,(H2,22,23,24,25)