N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloranyl-5-methylsulfanyl-benzamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloranyl-5-methylsulfanyl-benzamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloro-5-methylsulfanyl-benzamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloro-5-(methylthio)benzamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloro-5-methylsulfanylbenzamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-chloro-5-(methylthio)benzamide Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)SC)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)C3=C(C=CC(=C3)SC)Cl

InChI

InChI=1S/C17H14ClN3O2S2/c1-9(22)19-10-3-6-14-15(7-10)25-17(20-14)21-16(23)12-8-11(24-2)4-5-13(12)18/h3-8H,1-2H3,(H,19,22)(H,20,21,23)