N-(tert-butylcarbamoyl)-2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide

Systemtic Name: N-(tert-butylcarbamoyl)-2-[3-(2-chlorophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(tert-butylcarbamoyl)-2-[3-(2-chlorophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-[(tert-butylamino)-oxomethyl]-2-[[3-(2-chlorophenyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(tert-butylcarbamoyl)-2-[3-(2-chlorophenyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(tert-butylcarbamoyl)-2-[[3-(2-chlorophenyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C22H23ClN4O3S MolecularWeight: 458.96102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

Isomeric SMILES

CC(C(=O)NC(=O)NC(C)(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3=CC=CC=C3Cl

InChI

InChI=1S/C22H23ClN4O3S/c1-13(18(28)25-20(30)26-22(2,3)4)31-21-24-16-11-7-5-9-14(16)19(29)27(21)17-12-8-6-10-15(17)23/h5-13H,1-4H3,(H2,25,26,28,30)