N-[[5-[(3-fluorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide

Systemtic Name: N-[[5-[(3-fluorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Openeye Name: N-[[5-[(3-fluorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide CAS Name: N-[[5-[(3-fluorophenyl)methylthio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide IUPAC Name: N-[[5-[(3-fluorophenyl)methylsulfanyl]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxybenzamide Traditional Name: N-[[5-[(3-fluorobenzyl)thio]-4-phenethyl-1,2,4-triazol-3-yl]methyl]-4-methoxy-benzamide Formula: C26H25FN4O2S MolecularWeight: 476.565703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC4=CC(=CC=C4)F

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NCC2=NN=C(N2CCC3=CC=CC=C3)SCC4=CC(=CC=C4)F

InChI

InChI=1S/C26H25FN4O2S/c1-33-23-12-10-21(11-13-23)25(32)28-17-24-29-30-26(34-18-20-8-5-9-22(27)16-20)31(24)15-14-19-6-3-2-4-7-19/h2-13,16H,14-15,17-18H2,1H3,(H,28,32)