(2S)-2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(ethylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[7-chloranyl-3-(2-methoxy-5-methyl-phenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(ethylcarbamoyl)propanamide Openeye Name: (2S)-2-[7-chloro-3-(2-methoxy-5-methyl-phenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(ethylcarbamoyl)propanamide CAS Name: (2S)-2-[[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxo-2-quinazolinyl]thio]-N-(ethylcarbamoyl)propanamide IUPAC Name: (2S)-2-[7-chloro-3-(2-methoxy-5-methylphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(ethylcarbamoyl)propanamide Traditional Name: (2S)-2-[[7-chloro-4-keto-3-(2-methoxy-5-methyl-phenyl)quinazolin-2-yl]thio]-N-(ethylcarbamoyl)propionamide Formula: C22H23ClN4O4S MolecularWeight: 474.96042

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H23ClN4O4S/c1-5-24-21(30)26-19(28)13(3)32-22-25-16-11-14(23)7-8-15(16)20(29)27(22)17-10-12(2)6-9-18(17)31-4/h6-11,13H,5H2,1-4H3,(H2,24,26,28,30)/t13-/m0/s1