2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide

Systemtic Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)ethanamide Openeye Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-ethyl-6-methyl-phenyl)acetamide CAS Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)thio]-N-(2-ethyl-6-methylphenyl)acetamide IUPAC Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)sulfanyl]-N-(2-ethyl-6-methylphenyl)acetamide Traditional Name: 2-[(6-acetamido-1,3-benzothiazol-2-yl)thio]-N-(2-ethyl-6-methyl-phenyl)acetamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NC3=C(S2)C=C(C=C3)NC(=O)C)C

InChI

InChI=1S/C20H21N3O2S2/c1-4-14-7-5-6-12(2)19(14)23-18(25)11-26-20-22-16-9-8-15(21-13(3)24)10-17(16)27-20/h5-10H,4,11H2,1-3H3,(H,21,24)(H,23,25)