3-[5-[(3-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide

Systemtic Name: 3-[5-[(3-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide Openeye Name: 3-[5-[(3-fluorophenyl)methylsulfanyl]-4-(p-tolyl)-1,2,4-triazol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide CAS Name: 3-[5-[(3-fluorophenyl)methylthio]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide IUPAC Name: 3-[5-[(3-fluorophenyl)methylsulfanyl]-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-N-[(2-methoxyphenyl)methyl]propanamide Traditional Name: 3-[5-[(3-fluorobenzyl)thio]-4-(p-tolyl)-1,2,4-triazol-3-yl]-N-o-anisyl-propionamide Formula: C27H27FN4O2S MolecularWeight: 490.592283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)F)CCC(=O)NCC4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SCC3=CC(=CC=C3)F)CCC(=O)NCC4=CC=CC=C4OC

InChI

InChI=1S/C27H27FN4O2S/c1-19-10-12-23(13-11-19)32-25(30-31-27(32)35-18-20-6-5-8-22(28)16-20)14-15-26(33)29-17-21-7-3-4-9-24(21)34-2/h3-13,16H,14-15,17-18H2,1-2H3,(H,29,33)