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

Systemtic Name: 4-methoxy-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-3-(pyridin-4-ylmethoxy)benzenecarboximidate Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-methoxy-3-(4-pyridylmethoxy)benzenecarboximidate CAS Name: 4-methoxy-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-3-(pyridin-4-ylmethoxy)benzenecarboximidate IUPAC Name: 4-methoxy-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-3-(pyridin-4-ylmethoxy)benzenecarboximidate Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-methoxy-3-(4-pyridylmethoxy)benzenecarboximidate Formula: C23H21N6O3S2- MolecularWeight: 493.58124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(C2=CC(=C(C=C2)OC)OCC3=CC=NC=C3)[O-])C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(C2=CC(=C(C=C2)OC)OCC3=CC=NC=C3)[O-])C4=NNC(=S)N4CC=C

InChI

InChI=1S/C23H22N6O3S2/c1-4-11-29-20(27-28-23(29)33)19-14(2)25-22(34-19)26-21(30)16-5-6-17(31-3)18(12-16)32-13-15-7-9-24-10-8-15/h4-10,12H,1,11,13H2,2-3H3,(H,28,33)(H,25,26,30)/p-1