N-(butylcarbamoyl)-2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-(butylcarbamoyl)-2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-(butylcarbamoyl)-2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-[butylamino(oxo)methyl]-2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]acetamide IUPAC Name: N-(butylcarbamoyl)-2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanylacetamide Traditional Name: N-(butylcarbamoyl)-2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]acetamide Formula: C18H23ClN4O4S MolecularWeight: 426.91762

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCOC

Isomeric SMILES

CCCCNC(=O)NC(=O)CSC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCOC

InChI

InChI=1S/C18H23ClN4O4S/c1-3-4-7-20-17(26)22-15(24)11-28-18-21-14-10-12(19)5-6-13(14)16(25)23(18)8-9-27-2/h5-6,10H,3-4,7-9,11H2,1-2H3,(H2,20,22,24,26)