(4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate

Systemtic Name: (4-azanylidene-3-cyano-2-oxidanylidene-pentyl) 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: (3-cyano-4-imino-2-oxo-pentyl) 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid (3-cyano-4-imino-2-oxopentyl) ester IUPAC Name: (3-cyano-4-imino-2-oxopentyl) 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid (3-cyano-4-imino-2-keto-pentyl) ester Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CC(=N)C(C#N)C(=O)COC(=O)CN1C(=O)CSC2=CC=CC=C21

Isomeric SMILES

CC(=N)C(C#N)C(=O)COC(=O)CN1C(=O)CSC2=CC=CC=C21

InChI

InChI=1S/C16H15N3O4S/c1-10(18)11(6-17)13(20)8-23-16(22)7-19-12-4-2-3-5-14(12)24-9-15(19)21/h2-5,11,18H,7-9H2,1H3