2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-2-[[3-(4-isopropylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]quinazolin-4-one CAS Name: 2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 2-[[3-(4-propan-2-ylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-2-[(3-p-cumenyl-1,2,4-oxadiazol-5-yl)methylthio]quinazolin-4-one Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NOC(=N2)CSC3=NC4=CC=CC=C4C(=O)N3CC=C

InChI

InChI=1S/C23H22N4O2S/c1-4-13-27-22(28)18-7-5-6-8-19(18)24-23(27)30-14-20-25-21(26-29-20)17-11-9-16(10-12-17)15(2)3/h4-12,15H,1,13-14H2,2-3H3