(2S)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide

Systemtic Name: (2S)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Openeye Name: (2S)-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-isopropylphenyl)propanamide CAS Name: (2S)-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(4-propan-2-ylphenyl)propanamide IUPAC Name: (2S)-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(4-propan-2-ylphenyl)propanamide Traditional Name: (2S)-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-p-cumenyl-propionamide Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)C(C)C)SC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C23H27N3O3S/c1-15(2)17-9-11-18(12-10-17)24-21(28)16(3)30-23-25-20-8-5-4-7-19(20)22(29)26(23)13-6-14-27/h4-5,7-12,15-16,27H,6,13-14H2,1-3H3,(H,24,28)/t16-/m0/s1