(2R)-N-(tert-butylcarbamoyl)-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(tert-butylcarbamoyl)-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-(tert-butylcarbamoyl)propanamide CAS Name: (2R)-N-[(tert-butylamino)-oxomethyl]-2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-(tert-butylcarbamoyl)-2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]-N-(tert-butylcarbamoyl)propionamide Formula: C19H23ClN4O3S MolecularWeight: 422.92892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC=C

Isomeric SMILES

C[C@H](C(=O)NC(=O)NC(C)(C)C)SC1=NC2=C(C=C(C=C2)Cl)C(=O)N1CC=C

InChI

InChI=1S/C19H23ClN4O3S/c1-6-9-24-16(26)13-10-12(20)7-8-14(13)21-18(24)28-11(2)15(25)22-17(27)23-19(3,4)5/h6-8,10-11H,1,9H2,2-5H3,(H2,22,23,25,27)/t11-/m1/s1