2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-phenyl-quinazolin-4-amine

Systemtic Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-phenyl-quinazolin-4-amine Openeye Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-phenyl-quinazolin-4-amine CAS Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-N-phenyl-4-quinazolinamine IUPAC Name: 2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-N-phenylquinazolin-4-amine Traditional Name: [2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]quinazolin-4-yl]-phenyl-amine Formula: C23H16N6O3S MolecularWeight: 456.47654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC3=CC=CC=C32)SCC4=NN=C(O4)C5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C23H16N6O3S/c30-29(31)17-12-10-15(11-13-17)22-28-27-20(32-22)14-33-23-25-19-9-5-4-8-18(19)21(26-23)24-16-6-2-1-3-7-16/h1-13H,14H2,(H,24,25,26)