2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodanyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodanyl-4-methyl-phenyl)ethanamide Openeye Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodo-4-methyl-phenyl)acetamide CAS Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodo-4-methylphenyl)acetamide IUPAC Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodo-4-methylphenyl)acetamide Traditional Name: 2-[1,3-benzothiazol-2-ylmethyl(methyl)amino]-N-(3-iodo-4-methyl-phenyl)acetamide Formula: C18H18IN3OS MolecularWeight: 451.32449

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CN(C)CC2=NC3=CC=CC=C3S2)I

InChI

InChI=1S/C18H18IN3OS/c1-12-7-8-13(9-14(12)19)20-17(23)10-22(2)11-18-21-15-5-3-4-6-16(15)24-18/h3-9H,10-11H2,1-2H3,(H,20,23)