2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole

Systemtic Name: 2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-5-(3-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-5-(3-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylthio]-5-(3-nitrophenyl)-1,3,4-oxadiazole Formula: C19H13ClN4O3S MolecularWeight: 412.84952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NN=C(O3)C4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H13ClN4O3S/c1-11-14-7-2-3-8-15(14)21-16(17(11)20)10-28-19-23-22-18(27-19)12-5-4-6-13(9-12)24(25)26/h2-9H,10H2,1H3