4-ethyl-3-(furan-2-yl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole

Systemtic Name: 4-ethyl-3-(furan-2-yl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole Openeye Name: 4-ethyl-3-(2-furyl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole CAS Name: 4-ethyl-3-(2-furanyl)-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,2,4-triazole IUPAC Name: 4-ethyl-3-(furan-2-yl)-5-[(1R)-1-(3-nitrophenyl)ethyl]sulfanyl-1,2,4-triazole Traditional Name: 4-ethyl-3-(2-furyl)-5-[[(1R)-1-(3-nitrophenyl)ethyl]thio]-1,2,4-triazole Formula: C16H16N4O3S MolecularWeight: 344.38824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SC(C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CO3

Isomeric SMILES

CCN1C(=NN=C1S[C@H](C)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=CO3

InChI

InChI=1S/C16H16N4O3S/c1-3-19-15(14-8-5-9-23-14)17-18-16(19)24-11(2)12-6-4-7-13(10-12)20(21)22/h4-11H,3H2,1-2H3/t11-/m1/s1