7-chloranyl-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-pentyl-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-pentyl-quinazolin-4-one Openeye Name: 7-chloro-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-pentyl-quinazolin-4-one CAS Name: 7-chloro-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]-3-pentyl-4-quinazolinone IUPAC Name: 7-chloro-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylsulfanyl]-3-pentylquinazolin-4-one Traditional Name: 3-amyl-7-chloro-2-[[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]methylthio]quinazolin-4-one Formula: C22H20ClN5O4S MolecularWeight: 485.9433

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SCC3=NN=C(O3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN5O4S/c1-2-3-4-11-27-21(29)17-10-7-15(23)12-18(17)24-22(27)33-13-19-25-26-20(32-19)14-5-8-16(9-6-14)28(30)31/h5-10,12H,2-4,11,13H2,1H3