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

Systemtic Name: 3-[(3-methoxyphenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Openeye Name: 3-isopropyl-5-[(3-methoxyphenyl)methylsulfanyl]-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazole CAS Name: 3-[(3-methoxyphenyl)methylthio]-4-(2-oxolanylmethyl)-5-propan-2-yl-1,2,4-triazole IUPAC Name: 3-[(3-methoxyphenyl)methylsulfanyl]-4-(oxolan-2-ylmethyl)-5-propan-2-yl-1,2,4-triazole Traditional Name: 3-isopropyl-5-(m-anisylthio)-4-(tetrahydrofurfuryl)-1,2,4-triazole Formula: C18H25N3O2S MolecularWeight: 347.475

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)C1=NN=C(N1CC2CCCO2)SCC3=CC(=CC=C3)OC

InChI

InChI=1S/C18H25N3O2S/c1-13(2)17-19-20-18(21(17)11-16-8-5-9-23-16)24-12-14-6-4-7-15(10-14)22-3/h4,6-7,10,13,16H,5,8-9,11-12H2,1-3H3