(2R)-1-(3-bromanylphenoxy)-3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol

Systemtic Name: (2R)-1-(3-bromanylphenoxy)-3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Openeye Name: (2R)-1-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(3-bromophenoxy)propan-2-ol CAS Name: (2R)-1-(3-bromophenoxy)-3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-2-propanol IUPAC Name: (2R)-1-(3-bromophenoxy)-3-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propan-2-ol Traditional Name: (2R)-1-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-3-(3-bromophenoxy)propan-2-ol Formula: C19H19BrN4O2S MolecularWeight: 447.34876

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(COC2=CC(=CC=C2)Br)O)C3=CC=NC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SC[C@@H](COC2=CC(=CC=C2)Br)O)C3=CC=NC=C3

InChI

InChI=1S/C19H19BrN4O2S/c1-2-10-24-18(14-6-8-21-9-7-14)22-23-19(24)27-13-16(25)12-26-17-5-3-4-15(20)11-17/h2-9,11,16,25H,1,10,12-13H2/t16-/m1/s1