3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one CAS Name: 3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]-4-quinazolinone IUPAC Name: 3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 3-(7-methyloctyl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)methylthio]quinazolin-4-one Formula: C26H30N4O2S MolecularWeight: 462.607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=NN=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C26H30N4O2S/c1-19(2)12-6-3-4-11-17-30-25(31)21-15-9-10-16-22(21)27-26(30)33-18-23-28-29-24(32-23)20-13-7-5-8-14-20/h5,7-10,13-16,19H,3-4,6,11-12,17-18H2,1-2H3