4-(benzimidazol-1-yl)-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: 4-(benzimidazol-1-yl)-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]-4-(benzimidazol-1-yl)benzenecarboximidate CAS Name: 4-(1-benzimidazolyl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]benzenecarboximidate IUPAC Name: 4-(benzimidazol-1-yl)-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]-4-(benzimidazol-1-yl)benzenecarboximidate Formula: C23H18N7OS2- MolecularWeight: 472.56532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)N=C(C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)[O-])C5=NNC(=S)N5CC=C

Isomeric SMILES

CC1=C(SC(=N1)N=C(C2=CC=C(C=C2)N3C=NC4=CC=CC=C43)[O-])C5=NNC(=S)N5CC=C

InChI

InChI=1S/C23H19N7OS2/c1-3-12-29-20(27-28-23(29)32)19-14(2)25-22(33-19)26-21(31)15-8-10-16(11-9-15)30-13-24-17-6-4-5-7-18(17)30/h3-11,13H,1,12H2,2H3,(H,28,32)(H,25,26,31)/p-1