(2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-propan-2-ylphenoxy)propan-2-ol Openeye Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(2-isopropylphenoxy)propan-2-ol CAS Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-3-(2-propan-2-ylphenoxy)-2-propanol IUPAC Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-propan-2-ylphenoxy)propan-2-ol Traditional Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-3-(2-isopropylphenoxy)propan-2-ol Formula: C20H25N3O2S2 MolecularWeight: 403.5614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(COC2=CC=CC=C2C(C)C)O)C3=CC=CS3

Isomeric SMILES

CCN1C(=NN=C1SC[C@H](COC2=CC=CC=C2C(C)C)O)C3=CC=CS3

InChI

InChI=1S/C20H25N3O2S2/c1-4-23-19(18-10-7-11-26-18)21-22-20(23)27-13-15(24)12-25-17-9-6-5-8-16(17)14(2)3/h5-11,14-15,24H,4,12-13H2,1-3H3/t15-/m0/s1