3-(2-oxidanylidene-1,3-benzothiazol-3-yl)-N-(2H-1,2,3,4-tetrazol-5-yl)propanimidate

Systemtic Name: 3-(2-oxidanylidene-1,3-benzothiazol-3-yl)-N-(2H-1,2,3,4-tetrazol-5-yl)propanimidate Openeye Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-(2H-tetrazol-5-yl)propanimidate CAS Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-(2H-tetrazol-5-yl)propanimidate IUPAC Name: 3-(2-oxo-1,3-benzothiazol-3-yl)-N-(2H-tetrazol-5-yl)propanimidate Traditional Name: 3-(2-keto-1,3-benzothiazol-3-yl)-N-(2H-tetrazol-5-yl)propionimidate Formula: C11H9N6O2S- MolecularWeight: 289.29316

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C(=O)S2)CCC(=NC3=NNN=N3)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N(C(=O)S2)CCC(=NC3=NNN=N3)[O-]

InChI

InChI=1S/C11H10N6O2S/c18-9(12-10-13-15-16-14-10)5-6-17-7-3-1-2-4-8(7)20-11(17)19/h1-4H,5-6H2,(H2,12,13,14,15,16,18)/p-1