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

Systemtic Name: N-[(4-fluorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Openeye Name: N-[(4-fluorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide CAS Name: N-[(4-fluorophenyl)methylthio]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide IUPAC Name: N-[(4-fluorophenyl)methylsulfanyl]-N-[[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]phenyl]methyl]propanamide Traditional Name: N-[(4-fluorobenzyl)thio]-N-[2-methoxy-4-[4-(3-methoxyphenyl)-1,2,4-triazol-3-yl]benzyl]propionamide Formula: C27H27FN4O3S MolecularWeight: 506.591683

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(CC1=C(C=C(C=C1)C2=NN=CN2C3=CC(=CC=C3)OC)OC)SCC4=CC=C(C=C4)F

Isomeric SMILES

CCC(=O)N(CC1=C(C=C(C=C1)C2=NN=CN2C3=CC(=CC=C3)OC)OC)SCC4=CC=C(C=C4)F

InChI

InChI=1S/C27H27FN4O3S/c1-4-26(33)32(36-17-19-8-12-22(28)13-9-19)16-21-11-10-20(14-25(21)35-3)27-30-29-18-31(27)23-6-5-7-24(15-23)34-2/h5-15,18H,4,16-17H2,1-3H3