2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]quinazolin-4-one CAS Name: 2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[1-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]ethylthio]quinazolin-4-one Formula: C21H17N5O4S MolecularWeight: 435.45578

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC(C1=NN=C(O1)C2=CC=C(C=C2)[N+](=O)[O-])SC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C21H17N5O4S/c1-3-12-25-20(27)16-6-4-5-7-17(16)22-21(25)31-13(2)18-23-24-19(30-18)14-8-10-15(11-9-14)26(28)29/h3-11,13H,1,12H2,2H3