2-[[5-[[(4-bromophenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[5-[[(4-bromophenyl)amino]methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[[5-[(4-bromoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[[5-[(4-bromoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[5-[(4-bromoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[[5-[(4-bromoanilino)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-N-(4-methoxyphenyl)acetamide Formula: C24H22BrN5O2S MolecularWeight: 524.43278

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C3=CC=CC=C3)CNC4=CC=C(C=C4)Br

InChI

InChI=1S/C24H22BrN5O2S/c1-32-21-13-11-19(12-14-21)27-23(31)16-33-24-29-28-22(30(24)20-5-3-2-4-6-20)15-26-18-9-7-17(25)8-10-18/h2-14,26H,15-16H2,1H3,(H,27,31)