5-[(4-methylquinolin-2-yl)sulfanylmethyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole

Systemtic Name: 5-[(4-methylquinolin-2-yl)sulfanylmethyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-methyl-2-quinolyl)sulfanylmethyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole CAS Name: 5-[[(4-methyl-2-quinolinyl)thio]methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-methylquinolin-2-yl)sulfanylmethyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(4-methyl-2-quinolyl)thio]methyl]-3-(4-nitrophenyl)-1,2,4-oxadiazole Formula: C19H14N4O3S MolecularWeight: 378.40446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=CC=CC=C12)SCC3=NC(=NO3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC2=CC=CC=C12)SCC3=NC(=NO3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H14N4O3S/c1-12-10-18(20-16-5-3-2-4-15(12)16)27-11-17-21-19(22-26-17)13-6-8-14(9-7-13)23(24)25/h2-10H,11H2,1H3