tert-butyl 4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[(3-oxidanylidene-4H-1,4-benzothiazin-6-yl)carbonyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate CAS Name: 4-[oxo-(3-oxo-4H-1,4-benzothiazin-6-yl)methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3-oxo-4H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylate Traditional Name: 4-(3-keto-4H-1,4-benzothiazine-6-carbonyl)piperazine-1-carboxylic acid tert-butyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)SCC(=O)N3

InChI

InChI=1S/C18H23N3O4S/c1-18(2,3)25-17(24)21-8-6-20(7-9-21)16(23)12-4-5-14-13(10-12)19-15(22)11-26-14/h4-5,10H,6-9,11H2,1-3H3,(H,19,22)