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

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-(3-oxidanylidene-4H-1,4-benzothiazin-2-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate CAS Name: 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate Traditional Name: 2-(3-keto-4H-1,4-benzothiazin-2-yl)acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C18H14N2O3S2 MolecularWeight: 370.44536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(S2)CC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C18H14N2O3S2/c21-17(23-10-16-19-11-5-1-4-8-14(11)25-16)9-15-18(22)20-12-6-2-3-7-13(12)24-15/h1-8,15H,9-10H2,(H,20,22)