(2S)-1-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(thiophen-2-ylmethoxy)propan-2-ol

Systemtic Name: (2S)-1-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(thiophen-2-ylmethoxy)propan-2-ol Openeye Name: (2S)-1-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-3-(2-thienylmethoxy)propan-2-ol CAS Name: (2S)-1-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-3-(thiophen-2-ylmethoxy)-2-propanol IUPAC Name: (2S)-1-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-3-(thiophen-2-ylmethoxy)propan-2-ol Traditional Name: (2S)-1-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-3-(2-thenyloxy)propan-2-ol Formula: C18H20N4O2S2 MolecularWeight: 388.507

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=NN=C1SCC(COCC2=CC=CS2)O)C3=CC=NC=C3

Isomeric SMILES

C=CCN1C(=NN=C1SC[C@H](COCC2=CC=CS2)O)C3=CC=NC=C3

InChI

InChI=1S/C18H20N4O2S2/c1-2-9-22-17(14-5-7-19-8-6-14)20-21-18(22)26-13-15(23)11-24-12-16-4-3-10-25-16/h2-8,10,15,23H,1,9,11-13H2/t15-/m0/s1