6-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one Openeye Name: 6-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one CAS Name: 6-[3-(methylthio)propylamino]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one Traditional Name: 6-[3-(methylthio)propylamino]-4H-1,4-benzoxazin-3-one Formula: C12H16N2O2S MolecularWeight: 252.33264

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=CC2=C(C=C1)OCC(=O)N2

Isomeric SMILES

CSCCCNC1=CC2=C(C=C1)OCC(=O)N2

InChI

InChI=1S/C12H16N2O2S/c1-17-6-2-5-13-9-3-4-11-10(7-9)14-12(15)8-16-11/h3-4,7,13H,2,5-6,8H2,1H3,(H,14,15)