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

Systemtic Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Openeye Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide CAS Name: 2-[(4-fluorophenyl)methylthio]-N-[(2-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide IUPAC Name: 2-[(4-fluorophenyl)methylsulfanyl]-N-[(2-methoxyphenyl)methyl]-4-methyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Traditional Name: 2-[(4-fluorobenzyl)thio]-4-methyl-N-o-anisyl-6-phenyl-N-(1H-1,2,4-triazol-5-yl)hexanamide Formula: C30H33FN4O2S MolecularWeight: 532.672023

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC=C1)CC(C(=O)N(CC2=CC=CC=C2OC)C3=NC=NN3)SCC4=CC=C(C=C4)F

Isomeric SMILES

CC(CCC1=CC=CC=C1)CC(C(=O)N(CC2=CC=CC=C2OC)C3=NC=NN3)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C30H33FN4O2S/c1-22(12-13-23-8-4-3-5-9-23)18-28(38-20-24-14-16-26(31)17-15-24)29(36)35(30-32-21-33-34-30)19-25-10-6-7-11-27(25)37-2/h3-11,14-17,21-22,28H,12-13,18-20H2,1-2H3,(H,32,33,34)