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

Systemtic Name: 2-[(2S)-1-oxidanylidene-1-(4-propylphenyl)propan-2-yl]sulfanyl-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 3-(3-hydroxypropyl)-2-[(1S)-1-methyl-2-oxo-2-(4-propylphenyl)ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-(3-hydroxypropyl)-2-[[(2S)-1-oxo-1-(4-propylphenyl)propan-2-yl]thio]-4-quinazolinone IUPAC Name: 3-(3-hydroxypropyl)-2-[(2S)-1-oxo-1-(4-propylphenyl)propan-2-yl]sulfanylquinazolin-4-one Traditional Name: 3-(3-hydroxypropyl)-2-[[(1S)-2-keto-1-methyl-2-(4-propylphenyl)ethyl]thio]quinazolin-4-one Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C23H26N2O3S/c1-3-7-17-10-12-18(13-11-17)21(27)16(2)29-23-24-20-9-5-4-8-19(20)22(28)25(23)14-6-15-26/h4-5,8-13,16,26H,3,6-7,14-15H2,1-2H3/t16-/m0/s1