2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-iodanyl-4-methyl-phenyl)ethanamide

Systemtic Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-iodanyl-4-methyl-phenyl)ethanamide Openeye Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-iodo-4-methyl-phenyl)acetamide CAS Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(3-iodo-4-methylphenyl)acetamide IUPAC Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(3-iodo-4-methylphenyl)acetamide Traditional Name: 2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(3-iodo-4-methyl-phenyl)acetamide Formula: C17H16INO3S MolecularWeight: 441.28331

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=CC3=C(C=C2)OCCO3)I

InChI

InChI=1S/C17H16INO3S/c1-11-2-3-12(8-14(11)18)19-17(20)10-23-13-4-5-15-16(9-13)22-7-6-21-15/h2-5,8-9H,6-7,10H2,1H3,(H,19,20)