N-(2-bromophenyl)-2-[(5-methyl-4-quinolin-8-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-bromophenyl)-2-[(5-methyl-4-quinolin-8-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(2-bromophenyl)-2-[[5-methyl-4-(8-quinolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-bromophenyl)-2-[[5-methyl-4-(8-quinolinyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(2-bromophenyl)-2-[(5-methyl-4-quinolin-8-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(2-bromophenyl)-2-[[5-methyl-4-(8-quinolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C20H16BrN5OS MolecularWeight: 454.34294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC3=C2N=CC=C3)SCC(=O)NC4=CC=CC=C4Br

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC3=C2N=CC=C3)SCC(=O)NC4=CC=CC=C4Br

InChI

InChI=1S/C20H16BrN5OS/c1-13-24-25-20(28-12-18(27)23-16-9-3-2-8-15(16)21)26(13)17-10-4-6-14-7-5-11-22-19(14)17/h2-11H,12H2,1H3,(H,23,27)