(2S)-2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-N-ethyl-propanamide

Systemtic Name: (2S)-2-[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)ethanoylamino]-N-ethyl-propanamide Openeye Name: (2S)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-N-ethyl-propanamide CAS Name: (2S)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)-1-oxoethyl]amino]-N-ethylpropanamide IUPAC Name: (2S)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanyl)acetyl]amino]-N-ethylpropanamide Traditional Name: (2S)-2-[[2-(2,3-dihydro-1,4-benzodioxin-6-ylthio)acetyl]amino]-N-ethyl-propionamide Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)CSC1=CC2=C(C=C1)OCCO2

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)CSC1=CC2=C(C=C1)OCCO2

InChI

InChI=1S/C15H20N2O4S/c1-3-16-15(19)10(2)17-14(18)9-22-11-4-5-12-13(8-11)21-7-6-20-12/h4-5,8,10H,3,6-7,9H2,1-2H3,(H,16,19)(H,17,18)/t10-/m0/s1