1,3-benzothiazol-2-ylmethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylmethyl 2-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylmethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetate CAS Name: 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetic acid 1,3-benzothiazol-2-ylmethyl ester IUPAC Name: 1,3-benzothiazol-2-ylmethyl 2-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]acetate Traditional Name: 2-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]acetic acid 1,3-benzothiazol-2-ylmethyl ester Formula: C17H13N3O4S2 MolecularWeight: 387.43282

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCC(=O)OCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NS2(=O)=O)NCC(=O)OCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H13N3O4S2/c21-16(24-10-15-19-12-6-2-3-7-13(12)25-15)9-18-17-11-5-1-4-8-14(11)26(22,23)20-17/h1-8H,9-10H2,(H,18,20)