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

Systemtic Name: 6-bromanyl-3-[(1R)-1-phenylethyl]-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-4-one Openeye Name: 6-bromo-2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]-3-[(1R)-1-phenylethyl]quinazolin-4-one CAS Name: 6-bromo-3-[(1R)-1-phenylethyl]-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylthio]-4-quinazolinone IUPAC Name: 6-bromo-3-[(1R)-1-phenylethyl]-2-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methylsulfanyl]quinazolin-4-one Traditional Name: 6-bromo-2-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methylthio]-3-[(1R)-1-phenylethyl]quinazolin-4-one Formula: C22H21BrN4O2S MolecularWeight: 485.39674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NOC(=N1)CSC2=NC3=C(C=C(C=C3)Br)C(=O)N2C(C)C4=CC=CC=C4

Isomeric SMILES

C[C@H](C1=CC=CC=C1)N2C(=O)C3=C(C=CC(=C3)Br)N=C2SCC4=NC(=NO4)C(C)C

InChI

InChI=1S/C22H21BrN4O2S/c1-13(2)20-25-19(29-26-20)12-30-22-24-18-10-9-16(23)11-17(18)21(28)27(22)14(3)15-7-5-4-6-8-15/h4-11,13-14H,12H2,1-3H3/t14-/m1/s1