N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-quinolin-8-ylsulfanyl-ethanamide

Systemtic Name: N-[3-[(2-chloranyl-4-nitro-phenyl)amino]propyl]-2-quinolin-8-ylsulfanyl-ethanamide Openeye Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-(8-quinolylsulfanyl)acetamide CAS Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-(8-quinolinylthio)acetamide IUPAC Name: N-[3-(2-chloro-4-nitroanilino)propyl]-2-quinolin-8-ylsulfanylacetamide Traditional Name: N-[3-(2-chloro-4-nitro-anilino)propyl]-2-(8-quinolylthio)acetamide Formula: C20H19ClN4O3S MolecularWeight: 430.90786

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)SCC(=O)NCCCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)SCC(=O)NCCCNC3=C(C=C(C=C3)[N+](=O)[O-])Cl)N=CC=C2

InChI

InChI=1S/C20H19ClN4O3S/c21-16-12-15(25(27)28)7-8-17(16)22-10-3-11-23-19(26)13-29-18-6-1-4-14-5-2-9-24-20(14)18/h1-2,4-9,12,22H,3,10-11,13H2,(H,23,26)