2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C20H17BrN4O3S MolecularWeight: 473.34298

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NO3)C4=CC(=CC=C4)Br)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NO3)C4=CC(=CC=C4)Br)CCCO

InChI

InChI=1S/C20H17BrN4O3S/c21-14-6-3-5-13(11-14)18-23-17(28-24-18)12-29-20-22-16-8-2-1-7-15(16)19(27)25(20)9-4-10-26/h1-3,5-8,11,26H,4,9-10,12H2