N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-2,2-dimethyl-propanamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodanyl-phenyl]-2,2-dimethyl-propanamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-2,2-dimethyl-propanamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-2,2-dimethylpropanamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodophenyl]-2,2-dimethylpropanamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)-4-iodo-phenyl]-2,2-dimethyl-propionamide Formula: C18H17IN2OS MolecularWeight: 436.30985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=C(C=C(C=C1)I)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)C(=O)NC1=C(C=C(C=C1)I)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17IN2OS/c1-18(2,3)17(22)21-13-9-8-11(19)10-12(13)16-20-14-6-4-5-7-15(14)23-16/h4-10H,1-3H3,(H,21,22)