(2R)-N-aminocarbonyl-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-3-methyl-butanamide

Systemtic Name: (2R)-N-aminocarbonyl-2-(6-chloranyl-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl)sulfanyl-3-methyl-butanamide Openeye Name: (2R)-2-(3-allyl-6-chloro-4-oxo-quinazolin-2-yl)sulfanyl-N-carbamoyl-3-methyl-butanamide CAS Name: (2R)-N-carbamoyl-2-[(6-chloro-4-oxo-3-prop-2-enyl-2-quinazolinyl)thio]-3-methylbutanamide IUPAC Name: (2R)-N-carbamoyl-2-(6-chloro-4-oxo-3-prop-2-enylquinazolin-2-yl)sulfanyl-3-methylbutanamide Traditional Name: (2R)-2-[(3-allyl-6-chloro-4-keto-quinazolin-2-yl)thio]-N-carbamoyl-3-methyl-butyramide Formula: C17H19ClN4O3S MolecularWeight: 394.87576

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H19ClN4O3S/c1-4-7-22-15(24)11-8-10(18)5-6-12(11)20-17(22)26-13(9(2)3)14(23)21-16(19)25/h4-6,8-9,13H,1,7H2,2-3H3,(H3,19,21,23,25)/t13-/m1/s1