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

Systemtic Name: (2S)-1-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol Openeye Name: (2S)-1-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol CAS Name: (2S)-1-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]thio]-3-phenoxy-2-propanol IUPAC Name: (2S)-1-[[5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxypropan-2-ol Traditional Name: (2S)-1-[[5-methyl-4-(p-tolyl)-1,2,4-triazol-3-yl]thio]-3-phenoxy-propan-2-ol Formula: C19H21N3O2S MolecularWeight: 355.45394

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=NN=C2SCC(COC3=CC=CC=C3)O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=NN=C2SC[C@H](COC3=CC=CC=C3)O)C

InChI

InChI=1S/C19H21N3O2S/c1-14-8-10-16(11-9-14)22-15(2)20-21-19(22)25-13-17(23)12-24-18-6-4-3-5-7-18/h3-11,17,23H,12-13H2,1-2H3/t17-/m0/s1