N-[(2R)-butan-2-yl]-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[(2R)-butan-2-yl]-2-[7-chloranyl-3-(3-methylbutyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-(7-chloro-3-isopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1R)-1-methylpropyl]acetamide CAS Name: N-[(2R)-butan-2-yl]-2-[[7-chloro-3-(3-methylbutyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2R)-butan-2-yl]-2-[7-chloro-3-(3-methylbutyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[(7-chloro-3-isoamyl-4-keto-quinazolin-2-yl)thio]-N-[(1R)-1-methylpropyl]acetamide Formula: C19H26ClN3O2S MolecularWeight: 395.94664

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCC(C)C

Isomeric SMILES

CC[C@@H](C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCC(C)C

InChI

InChI=1S/C19H26ClN3O2S/c1-5-13(4)21-17(24)11-26-19-22-16-10-14(20)6-7-15(16)18(25)23(19)9-8-12(2)3/h6-7,10,12-13H,5,8-9,11H2,1-4H3,(H,21,24)/t13-/m1/s1