6-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-2-propyl-quinolin-4-amine

Systemtic Name: 6-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-2-propyl-quinolin-4-amine Openeye Name: 6-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-2-propyl-quinolin-4-amine CAS Name: 6-[3-[4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]-2-propyl-4-quinolinamine IUPAC Name: 6-[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]-2-propylquinolin-4-amine Traditional Name: [6-[3-[4-(methylthio)phenyl]-1,2,4-oxadiazol-5-yl]-2-propyl-4-quinolyl]amine Formula: C21H20N4OS MolecularWeight: 376.4747

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=C(C=C2)C3=NC(=NO3)C4=CC=C(C=C4)SC)C(=C1)N

Isomeric SMILES

CCCC1=NC2=C(C=C(C=C2)C3=NC(=NO3)C4=CC=C(C=C4)SC)C(=C1)N

InChI

InChI=1S/C21H20N4OS/c1-3-4-15-12-18(22)17-11-14(7-10-19(17)23-15)21-24-20(25-26-21)13-5-8-16(27-2)9-6-13/h5-12H,3-4H2,1-2H3,(H2,22,23)