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

Systemtic Name: N-[(2S)-butan-2-yl]-2-[7-chloranyl-3-(4-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[7-chloro-3-(4-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(1S)-1-methylpropyl]acetamide CAS Name: N-[(2S)-butan-2-yl]-2-[[7-chloro-3-(4-chlorophenyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-[(2S)-butan-2-yl]-2-[7-chloro-3-(4-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: 2-[[7-chloro-3-(4-chlorophenyl)-4-keto-quinazolin-2-yl]thio]-N-[(1S)-1-methylpropyl]acetamide Formula: C20H19Cl2N3O2S MolecularWeight: 436.35476

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[C@H](C)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H19Cl2N3O2S/c1-3-12(2)23-18(26)11-28-20-24-17-10-14(22)6-9-16(17)19(27)25(20)15-7-4-13(21)5-8-15/h4-10,12H,3,11H2,1-2H3,(H,23,26)/t12-/m0/s1