2-[(2-ethanoyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-3-nitro-phenyl)ethanamide

Systemtic Name: 2-[(2-ethanoyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-3-nitro-phenyl)ethanamide Openeye Name: 2-[[2-acetyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(4-methyl-3-nitro-phenyl)acetamide CAS Name: 2-[(2-acetyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-N-(4-methyl-3-nitrophenyl)acetamide IUPAC Name: 2-[(2-acetyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methyl-3-nitrophenyl)acetamide Traditional Name: 2-[[2-acetyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]-N-(4-methyl-3-nitro-phenyl)acetamide Formula: C18H16N6O4S MolecularWeight: 412.42244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C)C3=CC=NC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC(=NN2C(=O)C)C3=CC=NC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H16N6O4S/c1-11-3-4-14(9-15(11)24(27)28)20-16(26)10-29-18-21-17(22-23(18)12(2)25)13-5-7-19-8-6-13/h3-9H,10H2,1-2H3,(H,20,26)