1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol Openeye Name: 1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol CAS Name: 1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-3-phenoxy-2-propanol IUPAC Name: 1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxypropan-2-ol Traditional Name: 1-[[5-[(2-methylphenoxy)methyl]-4-phenyl-1,2,4-triazol-3-yl]thio]-3-phenoxy-propan-2-ol Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NN=C(N2C3=CC=CC=C3)SCC(COC4=CC=CC=C4)O

Isomeric SMILES

CC1=CC=CC=C1OCC2=NN=C(N2C3=CC=CC=C3)SCC(COC4=CC=CC=C4)O

InChI

InChI=1S/C25H25N3O3S/c1-19-10-8-9-15-23(19)31-17-24-26-27-25(28(24)20-11-4-2-5-12-20)32-18-21(29)16-30-22-13-6-3-7-14-22/h2-15,21,29H,16-18H2,1H3