(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(2-methylpropyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: (2S)-2-(3-isobutyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(5-methylisoxazol-3-yl)propanamide CAS Name: (2S)-N-(5-methyl-3-isoxazolyl)-2-[[3-(2-methylpropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[3-(2-methylpropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: (2S)-2-[(3-isobutyl-4-keto-quinazolin-2-yl)thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2CC(C)C

InChI

InChI=1S/C19H22N4O3S/c1-11(2)10-23-18(25)14-7-5-6-8-15(14)20-19(23)27-13(4)17(24)21-16-9-12(3)26-22-16/h5-9,11,13H,10H2,1-4H3,(H,21,22,24)/t13-/m0/s1