S-(1,3-benzothiazol-2-yl) (2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-hydroxyimino-ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-aminothiazol-4-yl)-2-hydroxyimino-ethanethioate CAS Name: (2E)-2-(2-amino-4-thiazolyl)-2-hydroxyiminoethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-amino-1,3-thiazol-4-yl)-2-hydroxyiminoethanethioate Traditional Name: (2E)-2-(2-aminothiazol-4-yl)-2-hydroximino-ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C12H8N4O2S3 MolecularWeight: 336.41252

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SC(=O)C(=NO)C3=CSC(=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SC(=O)/C(=N/O)/C3=CSC(=N3)N

InChI

InChI=1S/C12H8N4O2S3/c13-11-14-7(5-19-11)9(16-18)10(17)21-12-15-6-3-1-2-4-8(6)20-12/h1-5,18H,(H2,13,14)/b16-9+