(2R)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide

Systemtic Name: (2R)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-phenyl-propanamide Openeye Name: (2R)-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-phenyl-propanamide CAS Name: (2R)-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-phenylpropanamide IUPAC Name: (2R)-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-phenylpropanamide Traditional Name: (2R)-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-phenyl-propionamide Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)SC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

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

InChI

InChI=1S/C20H21N3O3S/c1-14(18(25)21-15-8-3-2-4-9-15)27-20-22-17-11-6-5-10-16(17)19(26)23(20)12-7-13-24/h2-6,8-11,14,24H,7,12-13H2,1H3,(H,21,25)/t14-/m1/s1