3-(4-methoxyphenyl)-5-[[(2S)-oxolan-2-yl]methylsulfanyl]-4-phenethyl-1,2,4-triazole

Systemtic Name: 3-(4-methoxyphenyl)-5-[[(2S)-oxolan-2-yl]methylsulfanyl]-4-phenethyl-1,2,4-triazole Openeye Name: 3-(4-methoxyphenyl)-4-phenethyl-5-[[(2S)-tetrahydrofuran-2-yl]methylsulfanyl]-1,2,4-triazole CAS Name: 3-(4-methoxyphenyl)-5-[[(2S)-2-oxolanyl]methylthio]-4-phenethyl-1,2,4-triazole IUPAC Name: 3-(4-methoxyphenyl)-5-[[(2S)-oxolan-2-yl]methylsulfanyl]-4-phenethyl-1,2,4-triazole Traditional Name: 3-(4-methoxyphenyl)-4-phenethyl-5-[[(2S)-tetrahydrofuran-2-yl]methylthio]-1,2,4-triazole Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SCC4CCCO4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2CCC3=CC=CC=C3)SC[C@@H]4CCCO4

InChI

InChI=1S/C22H25N3O2S/c1-26-19-11-9-18(10-12-19)21-23-24-22(28-16-20-8-5-15-27-20)25(21)14-13-17-6-3-2-4-7-17/h2-4,6-7,9-12,20H,5,8,13-16H2,1H3/t20-/m0/s1