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

Systemtic Name: 2-methyl-3-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Openeye Name: 2-methyl-3-[[4-phenethyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline CAS Name: 2-methyl-3-[[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline IUPAC Name: 2-methyl-3-[[4-phenethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]quinoxaline Traditional Name: 2-methyl-3-[[[4-phenethyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]methyl]quinoxaline Formula: C25H23N5S2 MolecularWeight: 457.61362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3CCC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1CSC3=NN=C(N3CCC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C25H23N5S2/c1-18-23(27-22-12-6-5-11-21(22)26-18)17-32-25-29-28-24(16-20-10-7-15-31-20)30(25)14-13-19-8-3-2-4-9-19/h2-12,15H,13-14,16-17H2,1H3