6-bromanyl-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one Openeye Name: 6-bromo-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one CAS Name: 6-bromo-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylthio]-3-(1-phenylethyl)-4-quinazolinone IUPAC Name: 6-bromo-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylsulfanyl]-3-(1-phenylethyl)quinazolin-4-one Traditional Name: 6-bromo-2-[(5-ethyl-1,3,4-oxadiazol-2-yl)methylthio]-3-(1-phenylethyl)quinazolin-4-one Formula: C21H19BrN4O2S MolecularWeight: 471.37016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(O1)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C(C)C4=CC=CC=C4

Isomeric SMILES

CCC1=NN=C(O1)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C(C)C4=CC=CC=C4

InChI

InChI=1S/C21H19BrN4O2S/c1-3-18-24-25-19(28-18)12-29-21-23-17-10-9-15(22)11-16(17)20(27)26(21)13(2)14-7-5-4-6-8-14/h4-11,13H,3,12H2,1-2H3