N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodanyl-benzamide

Systemtic Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodanyl-benzamide Openeye Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodo-benzamide CAS Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodobenzamide IUPAC Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodobenzamide Traditional Name: N-(4,5-dimethyl-1,3-benzothiazol-2-yl)-2-iodo-benzamide Formula: C16H13IN2OS MolecularWeight: 408.25669

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3=CC=CC=C3I)C

Isomeric SMILES

CC1=C(C2=C(C=C1)SC(=N2)NC(=O)C3=CC=CC=C3I)C

InChI

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