3-(2-propan-2-ylphenyl)-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]quinazolin-4-one

Systemtic Name: 3-(2-propan-2-ylphenyl)-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]quinazolin-4-one Openeye Name: 3-(2-isopropylphenyl)-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylsulfanyl]quinazolin-4-one CAS Name: 3-(2-propan-2-ylphenyl)-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylthio]-4-quinazolinone IUPAC Name: 3-(2-propan-2-ylphenyl)-2-[3-(3-pyridin-4-yl-1,2,4-oxadiazol-5-yl)propylsulfanyl]quinazolin-4-one Traditional Name: 3-o-cumenyl-2-[3-[3-(4-pyridyl)-1,2,4-oxadiazol-5-yl]propylthio]quinazolin-4-one Formula: C27H25N5O2S MolecularWeight: 483.5847

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCCC4=NC(=NO4)C5=CC=NC=C5

Isomeric SMILES

CC(C)C1=CC=CC=C1N2C(=O)C3=CC=CC=C3N=C2SCCCC4=NC(=NO4)C5=CC=NC=C5

InChI

InChI=1S/C27H25N5O2S/c1-18(2)20-8-4-6-11-23(20)32-26(33)21-9-3-5-10-22(21)29-27(32)35-17-7-12-24-30-25(31-34-24)19-13-15-28-16-14-19/h3-6,8-11,13-16,18H,7,12,17H2,1-2H3