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

Systemtic Name: 2-methyl-3-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Openeye Name: 2-methyl-3-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline CAS Name: 2-methyl-3-[[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline IUPAC Name: 2-methyl-3-[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Traditional Name: 2-methyl-3-[[[4-methyl-5-(4-nitrophenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline Formula: C19H16N6O2S MolecularWeight: 392.43434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3C)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3C)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H16N6O2S/c1-12-17(21-16-6-4-3-5-15(16)20-12)11-28-19-23-22-18(24(19)2)13-7-9-14(10-8-13)25(26)27/h3-10H,11H2,1-2H3