N-(tert-butylcarbamoyl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C19H26N4O4S MolecularWeight: 406.49914

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1CCCO

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1CCCO

InChI

InChI=1S/C19H26N4O4S/c1-12(15(25)21-17(27)22-19(2,3)4)28-18-20-14-9-6-5-8-13(14)16(26)23(18)10-7-11-24/h5-6,8-9,12,24H,7,10-11H2,1-4H3,(H2,21,22,25,27)