(2R)-N-tert-butyl-2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-tert-butyl-2-(7-chloranyl-4-oxidanylidene-3-propan-2-yl-quinazolin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-tert-butyl-2-(7-chloro-3-isopropyl-4-oxo-quinazolin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-tert-butyl-2-[(7-chloro-4-oxo-3-propan-2-yl-2-quinazolinyl)thio]propanamide IUPAC Name: (2R)-N-tert-butyl-2-(7-chloro-4-oxo-3-propan-2-ylquinazolin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-tert-butyl-2-[(7-chloro-3-isopropyl-4-keto-quinazolin-2-yl)thio]propionamide Formula: C18H24ClN3O2S MolecularWeight: 381.92006

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC(C)(C)C

Isomeric SMILES

C[C@H](C(=O)NC(C)(C)C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C(C)C

InChI

InChI=1S/C18H24ClN3O2S/c1-10(2)22-16(24)13-8-7-12(19)9-14(13)20-17(22)25-11(3)15(23)21-18(4,5)6/h7-11H,1-6H3,(H,21,23)/t11-/m1/s1