6-chloranyl-7-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-chloranyl-7-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one Openeye Name: 6-chloro-7-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one CAS Name: 6-chloro-7-[3-(methylthio)propylamino]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-chloro-7-(3-methylsulfanylpropylamino)-4H-1,4-benzoxazin-3-one Traditional Name: 6-chloro-7-[3-(methylthio)propylamino]-4H-1,4-benzoxazin-3-one Formula: C12H15ClN2O2S MolecularWeight: 286.7777

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC1=C(C=C2C(=C1)OCC(=O)N2)Cl

Isomeric SMILES

CSCCCNC1=C(C=C2C(=C1)OCC(=O)N2)Cl

InChI

InChI=1S/C12H15ClN2O2S/c1-18-4-2-3-14-9-6-11-10(5-8(9)13)15-12(16)7-17-11/h5-6,14H,2-4,7H2,1H3,(H,15,16)