N-(2-bromanyl-4-methyl-phenyl)-2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]ethanamide

Systemtic Name: N-(2-bromanyl-4-methyl-phenyl)-2-[(5-chloranyl-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]ethanamide Openeye Name: N-(2-bromo-4-methyl-phenyl)-2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]acetamide CAS Name: N-(2-bromo-4-methylphenyl)-2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]acetamide IUPAC Name: N-(2-bromo-4-methylphenyl)-2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylsulfanyl]acetamide Traditional Name: N-(2-bromo-4-methyl-phenyl)-2-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methylthio]acetamide Formula: C18H17BrClNO3S MolecularWeight: 442.75448

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC3=C(C(=C2)Cl)OCCO3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CSCC2=CC3=C(C(=C2)Cl)OCCO3)Br

InChI

InChI=1S/C18H17BrClNO3S/c1-11-2-3-15(13(19)6-11)21-17(22)10-25-9-12-7-14(20)18-16(8-12)23-4-5-24-18/h2-3,6-8H,4-5,9-10H2,1H3,(H,21,22)