[2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate

Systemtic Name: [2-oxidanylidene-2-[(2-propan-2-ylphenyl)amino]ethyl] 2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoate Openeye Name: [2-(2-isopropylanilino)-2-oxo-ethyl] 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate CAS Name: 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetic acid [2-oxo-2-(2-propan-2-ylanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2-propan-2-ylanilino)ethyl] 2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetate Traditional Name: 2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]acetic acid [2-(2-isopropylanilino)-2-keto-ethyl] ester Formula: C21H22N2O4S MolecularWeight: 398.47538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)COC(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)COC(=O)C[C@@H]2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C21H22N2O4S/c1-13(2)14-7-3-4-8-15(14)22-19(24)12-27-20(25)11-18-21(26)23-16-9-5-6-10-17(16)28-18/h3-10,13,18H,11-12H2,1-2H3,(H,22,24)(H,23,26)/t18-/m1/s1