prop-2-ynyl 2-[(2E)-2-prop-2-ynoxycarbonyloxyimino-1,3-benzothiazol-3-yl]ethylsulfanylmethanoate

Systemtic Name: prop-2-ynyl 2-[(2E)-2-prop-2-ynoxycarbonyloxyimino-1,3-benzothiazol-3-yl]ethylsulfanylmethanoate Openeye Name: prop-2-ynyl 2-[(2E)-2-prop-2-ynoxycarbonyloxyimino-1,3-benzothiazol-3-yl]ethylsulfanylformate CAS Name: [2-[(2E)-2-[oxo(prop-2-ynoxy)methoxy]imino-1,3-benzothiazol-3-yl]ethylthio]formic acid prop-2-ynyl ester IUPAC Name: prop-2-ynyl 2-[(2E)-2-prop-2-ynoxycarbonyloxyimino-1,3-benzothiazol-3-yl]ethylsulfanylformate Traditional Name: [2-[(2E)-2-propargyloxycarbonyloximino-1,3-benzothiazol-3-yl]ethylthio]formic acid propargyl ester Formula: C17H14N2O5S2 MolecularWeight: 390.43346

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Descriptors Computed from Structure

Canonical SMILES:

C#CCOC(=O)ON=C1N(C2=CC=CC=C2S1)CCSC(=O)OCC#C

Isomeric SMILES

C#CCOC(=O)O/N=C/1\N(C2=CC=CC=C2S1)CCSC(=O)OCC#C

InChI

InChI=1S/C17H14N2O5S2/c1-3-10-22-16(20)24-18-15-19(9-12-25-17(21)23-11-4-2)13-7-5-6-8-14(13)26-15/h1-2,5-8H,9-12H2/b18-15+