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

Systemtic Name: O-(1,3-benzothiazol-2-yl) 2-(2-azanyl-1,3-thiazol-4-yl)ethanethioate Openeye Name: O-(1,3-benzothiazol-2-yl) 2-(2-aminothiazol-4-yl)ethanethioate CAS Name: 2-(2-amino-4-thiazolyl)ethanethioic acid O-(1,3-benzothiazol-2-yl) ester IUPAC Name: O-(1,3-benzothiazol-2-yl) 2-(2-amino-1,3-thiazol-4-yl)ethanethioate Traditional Name: 2-(2-aminothiazol-4-yl)ethanethioic acid O-(1,3-benzothiazol-2-yl) ester Formula: C12H9N3OS3 MolecularWeight: 307.41436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)OC(=S)CC3=CSC(=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)OC(=S)CC3=CSC(=N3)N

InChI

InChI=1S/C12H9N3OS3/c13-11-14-7(6-18-11)5-10(17)16-12-15-8-3-1-2-4-9(8)19-12/h1-4,6H,5H2,(H2,13,14)