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

Systemtic Name: N-(3-bromophenyl)-2-[7-chloranyl-4-oxidanylidene-3-(2-oxidanylpropyl)quinazolin-2-yl]sulfanyl-propanamide Openeye Name: N-(3-bromophenyl)-2-[7-chloro-3-(2-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-propanamide CAS Name: N-(3-bromophenyl)-2-[[7-chloro-3-(2-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]propanamide IUPAC Name: N-(3-bromophenyl)-2-[7-chloro-3-(2-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanylpropanamide Traditional Name: N-(3-bromophenyl)-2-[[7-chloro-3-(2-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]propionamide Formula: C20H19BrClN3O3S MolecularWeight: 496.80516

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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)Br)O

Isomeric SMILES

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

InChI

InChI=1S/C20H19BrClN3O3S/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)