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

Systemtic Name: N-(3-bromophenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3-bromophenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-bromophenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(3-bromophenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(3-bromophenyl)-2-[[5-[(4-methylphenoxy)methyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H23BrN4O2S MolecularWeight: 523.44472

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)Br)COC4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)Br)COC4=CC=C(C=C4)C

InChI

InChI=1S/C25H23BrN4O2S/c1-17-6-10-21(11-7-17)30-23(15-32-22-12-8-18(2)9-13-22)28-29-25(30)33-16-24(31)27-20-5-3-4-19(26)14-20/h3-14H,15-16H2,1-2H3,(H,27,31)