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

Systemtic Name: 3-(furan-2-ylcarbonylamino)-4-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(furan-2-carbonylamino)-4-methyl-benzenecarboximidate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]-4-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzenecarboximidate IUPAC Name: 3-(furan-2-carbonylamino)-4-methyl-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]benzenecarboximidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(2-furoylamino)-4-methyl-benzenecarboximidate Formula: C22H19N6O3S2- MolecularWeight: 479.55466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)[O-])NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=NC2=NC(=C(S2)C3=NNC(=S)N3CC=C)C)[O-])NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H20N6O3S2/c1-4-9-28-18(26-27-22(28)32)17-13(3)23-21(33-17)25-19(29)14-8-7-12(2)15(11-14)24-20(30)16-6-5-10-31-16/h4-8,10-11H,1,9H2,2-3H3,(H,24,30)(H,27,32)(H,23,25,29)/p-1