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

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-prop-2-enyl-propanamide Openeye Name: N-allyl-2-[7-chloro-3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: 2-[[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-prop-2-enylpropanamide IUPAC Name: 2-[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-prop-2-enylpropanamide Traditional Name: N-allyl-2-[[7-chloro-3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C20H26ClN3O3S MolecularWeight: 423.95674

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NCC=C

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NCC=C

InChI

InChI=1S/C20H26ClN3O3S/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/h5,7-8,12-14H,1,6,9-11H2,2-4H3,(H,22,25)