4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,6-dimethylphenyl)butanamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,6-dimethylphenyl)butanamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,6-dimethylphenyl)butanamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(2,6-dimethylphenyl)butanamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2,6-dimethylphenyl)butanamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(2,6-dimethylphenyl)butyramide Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CCCSC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H23NO3S/c1-14-5-3-6-15(2)20(14)21-19(22)7-4-12-25-16-8-9-17-18(13-16)24-11-10-23-17/h3,5-6,8-9,13H,4,7,10-12H2,1-2H3,(H,21,22)