2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide

Systemtic Name: 2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Openeye Name: 2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide CAS Name: 2-[(2-chloro-4-fluorophenyl)methylthio]-N-[(4-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide IUPAC Name: 2-[(2-chloro-4-fluorophenyl)methylsulfanyl]-N-[(4-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Traditional Name: 2-[(2-chloro-4-fluoro-benzyl)thio]-4-methyl-N-p-anisyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Formula: C30H32ClFN4O2S MolecularWeight: 567.117083

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)CC(C(=O)N(CC2=CC=C(C=C2)OC)C3=NC=NN3)SCC4=C(C=C(C=C4)F)Cl

Isomeric SMILES

CC(CCC1=CC=CC=C1)CC(C(=O)N(CC2=CC=C(C=C2)OC)C3=NC=NN3)SCC4=C(C=C(C=C4)F)Cl

InChI

InChI=1S/C30H32ClFN4O2S/c1-21(8-9-22-6-4-3-5-7-22)16-28(39-19-24-12-13-25(32)17-27(24)31)29(37)36(30-33-20-34-35-30)18-23-10-14-26(38-2)15-11-23/h3-7,10-15,17,20-21,28H,8-9,16,18-19H2,1-2H3,(H,33,34,35)