1,3-benzothiazol-2-ylmethyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate CAS Name: 3-(3-oxo-1,4-benzothiazin-4-yl)propanoic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 3-(3-oxo-1,4-benzothiazin-4-yl)propanoate Traditional Name: 3-(3-keto-1,4-benzothiazin-4-yl)propionic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C19H16N2O3S2 MolecularWeight: 384.47194

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2S1)CCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H16N2O3S2/c22-18-12-25-16-8-4-2-6-14(16)21(18)10-9-19(23)24-11-17-20-13-5-1-3-7-15(13)26-17/h1-8H,9-12H2