methyl 3-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)propanoate

Systemtic Name: methyl 3-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)propanoate Openeye Name: methyl 3-(3-thioxo-4H-1,4-benzothiazin-2-yl)propanoate CAS Name: 3-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)propanoic acid methyl ester IUPAC Name: methyl 3-(3-sulfanylidene-4H-1,4-benzothiazin-2-yl)propanoate Traditional Name: 3-(3-thioxo-4H-1,4-benzothiazin-2-yl)propionic acid methyl ester Formula: C12H13NO2S2 MolecularWeight: 267.36712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC1C(=S)NC2=CC=CC=C2S1

Isomeric SMILES

COC(=O)CCC1C(=S)NC2=CC=CC=C2S1

InChI

InChI=1S/C12H13NO2S2/c1-15-11(14)7-6-10-12(16)13-8-4-2-3-5-9(8)17-10/h2-5,10H,6-7H2,1H3,(H,13,16)