5-chloranyl-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide

Systemtic Name: 5-chloranyl-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide Openeye Name: 5-chloro-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide CAS Name: 5-chloro-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide IUPAC Name: 5-chloro-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide Traditional Name: 5-chloro-N-(3,4-dimethylphenyl)-2,1-benzothiazole-3-carboxamide Formula: C16H13ClN2OS MolecularWeight: 316.80522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C3C=C(C=CC3=NS2)Cl)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C3C=C(C=CC3=NS2)Cl)C

InChI

InChI=1S/C16H13ClN2OS/c1-9-3-5-12(7-10(9)2)18-16(20)15-13-8-11(17)4-6-14(13)19-21-15/h3-8H,1-2H3,(H,18,20)