1,3-benzothiazol-2-ylsulfanyl (2E)-2-acetyloxyimino-2-(2-azanyl-1,3-thiazol-4-yl)ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-acetyloxyimino-2-(2-azanyl-1,3-thiazol-4-yl)ethanoate Openeye Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-acetoxyimino-2-(2-aminothiazol-4-yl)acetate CAS Name: (2E)-2-acetyloxyimino-2-(2-amino-4-thiazolyl)acetic acid (1,3-benzothiazol-2-ylthio) ester IUPAC Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-acetyloxyimino-2-(2-amino-1,3-thiazol-4-yl)acetate Traditional Name: (2E)-2-acetyloximino-2-(2-aminothiazol-4-yl)acetic acid (1,3-benzothiazol-2-ylthio) ester Formula: C14H10N4O4S3 MolecularWeight: 394.4486

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)ON=C(C1=CSC(=N1)N)C(=O)OSC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)O/N=C(\C1=CSC(=N1)N)/C(=O)OSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H10N4O4S3/c1-7(19)21-18-11(9-6-23-13(15)16-9)12(20)22-25-14-17-8-4-2-3-5-10(8)24-14/h2-6H,1H3,(H2,15,16)/b18-11+