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

Systemtic Name: S-(1,3-benzothiazol-2-yl) 2-(2-azanyl-1,3-thiazol-4-yl)-2-oxidanylidene-ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) 2-(2-aminothiazol-4-yl)-2-oxo-ethanethioate CAS Name: 2-(2-amino-4-thiazolyl)-2-oxoethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) 2-(2-amino-1,3-thiazol-4-yl)-2-oxoethanethioate Traditional Name: 2-(2-aminothiazol-4-yl)-2-keto-ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C12H7N3O2S3 MolecularWeight: 321.39788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H7N3O2S3/c13-11-14-7(5-18-11)9(16)10(17)20-12-15-6-3-1-2-4-8(6)19-12/h1-5H,(H2,13,14)