N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodanyl-benzamide

Systemtic Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodanyl-benzamide Openeye Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodo-benzamide CAS Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodobenzamide IUPAC Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodobenzamide Traditional Name: N-(3,6-dimethyl-1,3-benzothiazol-2-ylidene)-2-iodo-benzamide Formula: C16H13IN2OS MolecularWeight: 408.25669

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3I)S2)C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=CC=C3I)S2)C

InChI

InChI=1S/C16H13IN2OS/c1-10-7-8-13-14(9-10)21-16(19(13)2)18-15(20)11-5-3-4-6-12(11)17/h3-9H,1-2H3