methyl 2-(6-methyl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoate

Systemtic Name: methyl 2-(6-methyl-3-sulfanylidene-1,4-benzoxazin-4-yl)ethanoate Openeye Name: methyl 2-(6-methyl-3-thioxo-1,4-benzoxazin-4-yl)acetate CAS Name: 2-(6-methyl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetic acid methyl ester IUPAC Name: methyl 2-(6-methyl-3-sulfanylidene-1,4-benzoxazin-4-yl)acetate Traditional Name: 2-(6-methyl-3-thioxo-1,4-benzoxazin-4-yl)acetic acid methyl ester Formula: C12H13NO3S MolecularWeight: 251.30152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OCC(=S)N2CC(=O)OC

Isomeric SMILES

CC1=CC2=C(C=C1)OCC(=S)N2CC(=O)OC

InChI

InChI=1S/C12H13NO3S/c1-8-3-4-10-9(5-8)13(6-12(14)15-2)11(17)7-16-10/h3-5H,6-7H2,1-2H3