1,3-benzothiazol-2-ylsulfanyl (2E)-2-[(2-azanyl-1,3-thiazol-4-yl)methoxyimino]ethanoate

Systemtic Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-[(2-azanyl-1,3-thiazol-4-yl)methoxyimino]ethanoate Openeye Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-[(2-aminothiazol-4-yl)methoxyimino]acetate CAS Name: (2E)-2-[(2-amino-4-thiazolyl)methoxyimino]acetic acid (1,3-benzothiazol-2-ylthio) ester IUPAC Name: 1,3-benzothiazol-2-ylsulfanyl (2E)-2-[(2-amino-1,3-thiazol-4-yl)methoxyimino]acetate Traditional Name: (2E)-2-[(2-aminothiazol-4-yl)methyloximino]acetic acid (1,3-benzothiazol-2-ylthio) ester Formula: C13H10N4O3S3 MolecularWeight: 366.4385

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)SOC(=O)C=NOCC3=CSC(=N3)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)SOC(=O)/C=N/OCC3=CSC(=N3)N

InChI

InChI=1S/C13H10N4O3S3/c14-12-16-8(7-21-12)6-19-15-5-11(18)20-23-13-17-9-3-1-2-4-10(9)22-13/h1-5,7H,6H2,(H2,14,16)/b15-5+