[2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate

Systemtic Name: [2-[(4-acetamidophenyl)amino]-2-oxidanylidene-ethyl] 2-(3-oxidanylidene-1,4-benzothiazin-4-yl)ethanoate Openeye Name: [2-(4-acetamidoanilino)-2-oxo-ethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate CAS Name: 2-(3-oxo-1,4-benzothiazin-4-yl)acetic acid [2-(4-acetamidoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-acetamidoanilino)-2-oxoethyl] 2-(3-oxo-1,4-benzothiazin-4-yl)acetate Traditional Name: 2-(3-keto-1,4-benzothiazin-4-yl)acetic acid [2-(4-acetamidoanilino)-2-keto-ethyl] ester Formula: C20H19N3O5S MolecularWeight: 413.44696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)NC(=O)COC(=O)CN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C20H19N3O5S/c1-13(24)21-14-6-8-15(9-7-14)22-18(25)11-28-20(27)10-23-16-4-2-3-5-17(16)29-12-19(23)26/h2-9H,10-12H2,1H3,(H,21,24)(H,22,25)