4-(3-methoxypropyl)-3-[2-(5-methylthiophen-2-yl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3-methoxypropyl)-3-[2-(5-methylthiophen-2-yl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3-methoxypropyl)-3-[2-(5-methyl-2-thienyl)-4-quinolyl]-1H-1,2,4-triazole-5-thione CAS Name: 4-(3-methoxypropyl)-3-[2-(5-methyl-2-thiophenyl)-4-quinolinyl]-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3-methoxypropyl)-3-[2-(5-methylthiophen-2-yl)quinolin-4-yl]-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3-methoxypropyl)-3-[2-(5-methyl-2-thienyl)-4-quinolyl]-1H-1,2,4-triazole-5-thione Formula: C20H20N4OS2 MolecularWeight: 396.529

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CCCOC

Isomeric SMILES

CC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C4=NNC(=S)N4CCCOC

InChI

InChI=1S/C20H20N4OS2/c1-13-8-9-18(27-13)17-12-15(14-6-3-4-7-16(14)21-17)19-22-23-20(26)24(19)10-5-11-25-2/h3-4,6-9,12H,5,10-11H2,1-2H3,(H,23,26)