(2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-methylpropyl)propanamide

Systemtic Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-methylpropyl)propanamide Openeye Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-isobutyl-propanamide CAS Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-(2-methylpropyl)propanamide IUPAC Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)-N-(2-methylpropyl)propanamide Traditional Name: (2S)-2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-N-isobutyl-propionamide Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)SC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)SC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C15H21NO3S/c1-10(2)9-16-15(17)11(3)20-12-4-5-13-14(8-12)19-7-6-18-13/h4-5,8,10-11H,6-7,9H2,1-3H3,(H,16,17)/t11-/m0/s1