3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide

Systemtic Name: 3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide Openeye Name: 3-(2-amino-2-oxo-ethyl)sulfanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide CAS Name: 3-[(2-amino-2-oxoethyl)thio]-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide IUPAC Name: 3-(2-amino-2-oxoethyl)sulfanyl-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propanamide Traditional Name: 3-[(2-amino-2-keto-ethyl)thio]-N-[1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]propionamide Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CCSCC(=O)N

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCO2)NC(=O)CCSCC(=O)N

InChI

InChI=1S/C15H20N2O4S/c1-10(17-15(19)4-7-22-9-14(16)18)11-2-3-12-13(8-11)21-6-5-20-12/h2-3,8,10H,4-7,9H2,1H3,(H2,16,18)(H,17,19)