3-(1,3-benzothiazol-2-yl)-N-(4-iodanyl-2-methyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-yl)-N-(4-iodanyl-2-methyl-phenyl)propanamide Openeye Name: 3-(1,3-benzothiazol-2-yl)-N-(4-iodo-2-methyl-phenyl)propanamide CAS Name: 3-(1,3-benzothiazol-2-yl)-N-(4-iodo-2-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzothiazol-2-yl)-N-(4-iodo-2-methylphenyl)propanamide Traditional Name: 3-(1,3-benzothiazol-2-yl)-N-(4-iodo-2-methyl-phenyl)propionamide Formula: C17H15IN2OS MolecularWeight: 422.28327

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC(=O)CCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC(=O)CCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15IN2OS/c1-11-10-12(18)6-7-13(11)19-16(21)8-9-17-20-14-4-2-3-5-15(14)22-17/h2-7,10H,8-9H2,1H3,(H,19,21)