2-(furan-2-ylcarbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate

Systemtic Name: 2-(furan-2-ylcarbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(furan-2-carbonylamino)ethanimidate CAS Name: 2-[[2-furanyl(oxo)methyl]amino]-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]ethanimidate IUPAC Name: 2-(furan-2-carbonylamino)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]ethanimidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-2-(2-furoylamino)acetimidate Formula: C16H15N6O3S2- MolecularWeight: 403.4587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(CNC(=O)C2=CC=CO2)[O-])C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(CNC(=O)C2=CC=CO2)[O-])C3=NNC(=S)N3CC=C

InChI

InChI=1S/C16H16N6O3S2/c1-3-6-22-13(20-21-16(22)26)12-9(2)18-15(27-12)19-11(23)8-17-14(24)10-5-4-7-25-10/h3-5,7H,1,6,8H2,2H3,(H,17,24)(H,21,26)(H,18,19,23)/p-1