(2R)-N-(2-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-nitrophenyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: (2R)-N-(2-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: (2R)-N-(2-nitrophenyl)-2-[(4-propyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: (2R)-N-(2-nitrophenyl)-2-[[4-propyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C19H20N6O3S MolecularWeight: 412.4655

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SC(C)C(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=NC=C3

Isomeric SMILES

CCCN1C(=NN=C1S[C@H](C)C(=O)NC2=CC=CC=C2[N+](=O)[O-])C3=CC=NC=C3

InChI

InChI=1S/C19H20N6O3S/c1-3-12-24-17(14-8-10-20-11-9-14)22-23-19(24)29-13(2)18(26)21-15-6-4-5-7-16(15)25(27)28/h4-11,13H,3,12H2,1-2H3,(H,21,26)/t13-/m1/s1