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

Systemtic Name: 2-[(2-methylquinazolin-4-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Openeye Name: 2-[(2-methylquinazolin-4-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole CAS Name: 2-[[(2-methyl-4-quinazolinyl)thio]methyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole IUPAC Name: 2-[(2-methylquinazolin-4-yl)sulfanylmethyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Traditional Name: 2-[[(2-methylquinazolin-4-yl)thio]methyl]-5-(4-nitrophenyl)-1,3,4-oxadiazole Formula: C18H13N5O3S MolecularWeight: 379.39252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H13N5O3S/c1-11-19-15-5-3-2-4-14(15)18(20-11)27-10-16-21-22-17(26-16)12-6-8-13(9-7-12)23(24)25/h2-9H,10H2,1H3