1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)propan-1-one

Systemtic Name: 1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)propan-1-one Openeye Name: 1-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)propan-1-one CAS Name: 1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)-1-propanone IUPAC Name: 1-(2-methyl-3-sulfanylidene-4H-1,4-benzoxazin-6-yl)propan-1-one Traditional Name: 1-(2-methyl-3-thioxo-4H-1,4-benzoxazin-6-yl)propan-1-one Formula: C12H13NO2S MolecularWeight: 235.30212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C=C1)OC(C(=S)N2)C

Isomeric SMILES

CCC(=O)C1=CC2=C(C=C1)OC(C(=S)N2)C

InChI

InChI=1S/C12H13NO2S/c1-3-10(14)8-4-5-11-9(6-8)13-12(16)7(2)15-11/h4-7H,3H2,1-2H3,(H,13,16)