4-(furan-2-ylmethyl)-3-[(2-methoxyphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 4-(furan-2-ylmethyl)-3-[(2-methoxyphenyl)methylsulfanyl]-5-(phenylmethyl)-1,2,4-triazole Openeye Name: 3-benzyl-4-(2-furylmethyl)-5-[(2-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 4-(2-furanylmethyl)-3-[(2-methoxyphenyl)methylthio]-5-(phenylmethyl)-1,2,4-triazole IUPAC Name: 3-benzyl-4-(furan-2-ylmethyl)-5-[(2-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 3-benzyl-4-(2-furfuryl)-5-(o-anisylthio)-1,2,4-triazole Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CO3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=CC=C1CSC2=NN=C(N2CC3=CC=CO3)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c1-26-20-12-6-5-10-18(20)16-28-22-24-23-21(14-17-8-3-2-4-9-17)25(22)15-19-11-7-13-27-19/h2-13H,14-16H2,1H3