2-methyl-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline

Systemtic Name: 2-methyl-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Openeye Name: 2-methyl-3-[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline CAS Name: 2-methyl-3-[[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]methyl]quinoxaline IUPAC Name: 2-methyl-3-[[4-(4-methylphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Traditional Name: 2-methyl-3-[[[5-phenyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline Formula: C25H21N5S MolecularWeight: 423.53274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4N=C3C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=NC4=CC=CC=C4N=C3C)C5=CC=CC=C5

InChI

InChI=1S/C25H21N5S/c1-17-12-14-20(15-13-17)30-24(19-8-4-3-5-9-19)28-29-25(30)31-16-23-18(2)26-21-10-6-7-11-22(21)27-23/h3-15H,16H2,1-2H3