tert-butyl 4-[2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[(2R)-3-oxidanylidene-4H-1,4-benzothiazin-2-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]piperazine-1-carboxylate CAS Name: 4-[1-oxo-2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]ethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(2R)-3-oxo-4H-1,4-benzothiazin-2-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(2R)-3-keto-4H-1,4-benzothiazin-2-yl]acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C19H25N3O4S MolecularWeight: 391.4845

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)CC2C(=O)NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C[C@@H]2C(=O)NC3=CC=CC=C3S2

InChI

InChI=1S/C19H25N3O4S/c1-19(2,3)26-18(25)22-10-8-21(9-11-22)16(23)12-15-17(24)20-13-6-4-5-7-14(13)27-15/h4-7,15H,8-12H2,1-3H3,(H,20,24)/t15-/m1/s1