2-[[5-[[(4-methyl-3-nitro-phenyl)amino]methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[5-[[(4-methyl-3-nitro-phenyl)amino]methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[5-[(4-methyl-3-nitro-anilino)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[5-[(4-methyl-3-nitroanilino)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[5-[(4-methyl-3-nitroanilino)methyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[[5-[(4-methyl-3-nitro-anilino)methyl]-1,3,4-oxadiazol-2-yl]thio]-N-(1-naphthyl)acetamide Formula: C22H19N5O4S MolecularWeight: 449.48236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=NN=C(O2)SCC(=O)NC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=NN=C(O2)SCC(=O)NC3=CC=CC4=CC=CC=C43)[N+](=O)[O-]

InChI

InChI=1S/C22H19N5O4S/c1-14-9-10-16(11-19(14)27(29)30)23-12-21-25-26-22(31-21)32-13-20(28)24-18-8-4-6-15-5-2-3-7-17(15)18/h2-11,23H,12-13H2,1H3,(H,24,28)