1,3-benzothiazol-2-ylmethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-oxidanylidene-4H-1,4-benzothiazine-6-carboxylate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate CAS Name: 3-oxo-4H-1,4-benzothiazine-6-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-oxo-4H-1,4-benzothiazine-6-carboxylate Traditional Name: 3-keto-4H-1,4-benzothiazine-6-carboxylic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H12N2O3S2 MolecularWeight: 356.41878

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C(=O)NC2=C(S1)C=CC(=C2)C(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H12N2O3S2/c20-15-9-23-13-6-5-10(7-12(13)18-15)17(21)22-8-16-19-11-3-1-2-4-14(11)24-16/h1-7H,8-9H2,(H,18,20)