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

Systemtic Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-methylphenoxy)propan-2-ol Openeye Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(2-methylphenoxy)propan-2-ol CAS Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-3-(2-methylphenoxy)-2-propanol IUPAC Name: (2S)-1-[(4-ethyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(2-methylphenoxy)propan-2-ol Traditional Name: (2S)-1-[[4-ethyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-3-(2-methylphenoxy)propan-2-ol Formula: C18H21N3O2S2 MolecularWeight: 375.50824

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H21N3O2S2/c1-3-21-17(16-9-6-10-24-16)19-20-18(21)25-12-14(22)11-23-15-8-5-4-7-13(15)2/h4-10,14,22H,3,11-12H2,1-2H3/t14-/m0/s1