2-[2-[2-[[5-[(4-bromanylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-1,3-thiazol-4-yl]-N-phenyl-ethanamide

Systemtic Name: 2-[2-[2-[[5-[(4-bromanylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]-1,3-thiazol-4-yl]-N-phenyl-ethanamide Openeye Name: 2-[2-[[2-[[5-[(4-bromophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiazol-4-yl]-N-phenyl-acetamide CAS Name: 2-[2-[[2-[[5-[(4-bromophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-1-oxoethyl]amino]-4-thiazolyl]-N-phenylacetamide IUPAC Name: 2-[2-[[2-[[5-[(4-bromophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-1,3-thiazol-4-yl]-N-phenylacetamide Traditional Name: 2-[2-[[2-[[5-[(4-bromophenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]acetyl]amino]thiazol-4-yl]-N-phenyl-acetamide Formula: C28H23BrN6O3S2 MolecularWeight: 635.55462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=C(C=C5)Br

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)CSC3=NN=C(N3C4=CC=CC=C4)COC5=CC=C(C=C5)Br

InChI

InChI=1S/C28H23BrN6O3S2/c29-19-11-13-23(14-12-19)38-16-24-33-34-28(35(24)22-9-5-2-6-10-22)40-18-26(37)32-27-31-21(17-39-27)15-25(36)30-20-7-3-1-4-8-20/h1-14,17H,15-16,18H2,(H,30,36)(H,31,32,37)