2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-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-(1-methylidene-3-oxidanylidene-isoindol-2-yl)-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-(1-methylene-3-oxo-isoindolin-2-yl)ethanimidate CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]ethanimidate IUPAC Name: 2-(1-methylidene-3-oxoisoindol-2-yl)-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-(1-keto-3-methylene-isoindolin-2-yl)acetimidate Formula: C20H17N6O2S2- MolecularWeight: 437.51798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(CN2C(=C)C3=CC=CC=C3C2=O)[O-])C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(CN2C(=C)C3=CC=CC=C3C2=O)[O-])C4=NNC(=S)N4CC=C

InChI

InChI=1S/C20H18N6O2S2/c1-4-9-25-17(23-24-20(25)29)16-11(2)21-19(30-16)22-15(27)10-26-12(3)13-7-5-6-8-14(13)18(26)28/h4-8H,1,3,9-10H2,2H3,(H,24,29)(H,21,22,27)/p-1