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

Systemtic Name: (2S)-1-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol Openeye Name: (2S)-1-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxy-propan-2-ol CAS Name: (2S)-1-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-3-phenoxy-2-propanol IUPAC Name: (2S)-1-[[5-(4-methoxyphenyl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-3-phenoxypropan-2-ol Traditional Name: (2S)-1-[[4-isopropyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]thio]-3-phenoxy-propan-2-ol Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SCC(COC2=CC=CC=C2)O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(C)N1C(=NN=C1SC[C@H](COC2=CC=CC=C2)O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H25N3O3S/c1-15(2)24-20(16-9-11-18(26-3)12-10-16)22-23-21(24)28-14-17(25)13-27-19-7-5-4-6-8-19/h4-12,15,17,25H,13-14H2,1-3H3/t17-/m0/s1