2-[1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[2-(4-tert-butylphenyl)-1-methyl-2-oxo-ethyl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[[1-(4-tert-butylphenyl)-1-oxopropan-2-yl]thio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[1-(4-tert-butylphenyl)-1-oxopropan-2-yl]sulfanyl-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[[2-(4-tert-butylphenyl)-2-keto-1-methyl-ethyl]thio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C24H28N2O3S MolecularWeight: 424.55572

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)C(C)(C)C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C24H28N2O3S/c1-16(21(28)17-10-12-18(13-11-17)24(2,3)4)30-23-25-20-9-6-5-8-19(20)22(29)26(23)14-7-15-27/h5-6,8-13,16,27H,7,14-15H2,1-4H3