ethyl 2-[4-(cyanomethyl)-6-methyl-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: ethyl 2-[4-(cyanomethyl)-6-methyl-3-oxidanylidene-1,4-benzothiazin-2-yl]ethanoate Openeye Name: ethyl 2-[4-(cyanomethyl)-6-methyl-3-oxo-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[4-(cyanomethyl)-6-methyl-3-oxo-1,4-benzothiazin-2-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(cyanomethyl)-6-methyl-3-oxo-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[4-(cyanomethyl)-3-keto-6-methyl-1,4-benzothiazin-2-yl]acetic acid ethyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(=O)N(C2=C(S1)C=CC(=C2)C)CC#N

Isomeric SMILES

CCOC(=O)CC1C(=O)N(C2=C(S1)C=CC(=C2)C)CC#N

InChI

InChI=1S/C15H16N2O3S/c1-3-20-14(18)9-13-15(19)17(7-6-16)11-8-10(2)4-5-12(11)21-13/h4-5,8,13H,3,7,9H2,1-2H3