2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-propyl-propanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-propyl-propanamide Openeye Name: 2-[7-chloro-3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-propyl-propanamide CAS Name: 2-[[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-propylpropanamide IUPAC Name: 2-[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-propylpropanamide Traditional Name: 2-[[7-chloro-3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-propyl-propionamide Formula: C20H28ClN3O3S MolecularWeight: 425.97262

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCCOC(C)C

Isomeric SMILES

CCCNC(=O)C(C)SC1=NC2=C(C=CC(=C2)Cl)C(=O)N1CCCOC(C)C

InChI

InChI=1S/C20H28ClN3O3S/c1-5-9-22-18(25)14(4)28-20-23-17-12-15(21)7-8-16(17)19(26)24(20)10-6-11-27-13(2)3/h7-8,12-14H,5-6,9-11H2,1-4H3,(H,22,25)