2-[7-chloranyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-(3-chlorophenyl)propanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-N-(3-chlorophenyl)propanamide Openeye Name: 2-[7-chloro-3-(2-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(3-chlorophenyl)propanamide CAS Name: 2-[[7-chloro-3-(2-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-(3-chlorophenyl)propanamide IUPAC Name: 2-[7-chloro-3-(2-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(3-chlorophenyl)propanamide Traditional Name: 2-[[7-chloro-3-(2-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(3-chlorophenyl)propionamide Formula: C20H19Cl2N3O3S MolecularWeight: 452.35416

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC(=CC=C3)Cl)O

Isomeric SMILES

CC(CN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC(=CC=C3)Cl)O

InChI

InChI=1S/C20H19Cl2N3O3S/c1-11(26)10-25-19(28)16-7-6-14(22)9-17(16)24-20(25)29-12(2)18(27)23-15-5-3-4-13(21)8-15/h3-9,11-12,26H,10H2,1-2H3,(H,23,27)