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

Systemtic Name: N-[1-[5-[2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)ethanamide Openeye Name: N-[1-[5-[2-(4-bromo-3-chloro-anilino)-2-oxo-ethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide CAS Name: N-[1-[5-[[2-(4-bromo-3-chloroanilino)-2-oxoethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide IUPAC Name: N-[1-[5-[2-(4-bromo-3-chloroanilino)-2-oxoethyl]sulfanyl-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Traditional Name: N-[1-[5-[[2-(4-bromo-3-chloro-anilino)-2-keto-ethyl]thio]-4-methyl-1,2,4-triazol-3-yl]ethyl]-2-(4-methoxyphenyl)acetamide Formula: C22H23BrClN5O3S MolecularWeight: 552.87172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(N1C)SCC(=O)NC2=CC(=C(C=C2)Br)Cl)NC(=O)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC(C1=NN=C(N1C)SCC(=O)NC2=CC(=C(C=C2)Br)Cl)NC(=O)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H23BrClN5O3S/c1-13(25-19(30)10-14-4-7-16(32-3)8-5-14)21-27-28-22(29(21)2)33-12-20(31)26-15-6-9-17(23)18(24)11-15/h4-9,11,13H,10,12H2,1-3H3,(H,25,30)(H,26,31)