2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(2-nitrophenyl)propanamide

Systemtic Name: 2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]-N-(2-nitrophenyl)propanamide Openeye Name: 2-[1-(1-naphthyl)tetrazol-5-yl]sulfanyl-N-(2-nitrophenyl)propanamide CAS Name: 2-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]-N-(2-nitrophenyl)propanamide IUPAC Name: 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-(2-nitrophenyl)propanamide Traditional Name: 2-[[1-(1-naphthyl)tetrazol-5-yl]thio]-N-(2-nitrophenyl)propionamide Formula: C20H16N6O3S MolecularWeight: 420.44444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NN=NN2C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NN=NN2C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C20H16N6O3S/c1-13(19(27)21-16-10-4-5-11-18(16)26(28)29)30-20-22-23-24-25(20)17-12-6-8-14-7-2-3-9-15(14)17/h2-13H,1H3,(H,21,27)