(2R)-2-(4-bromanylphenoxy)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide

Systemtic Name: (2R)-2-(4-bromanylphenoxy)-N-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide Openeye Name: (2R)-2-(4-bromophenoxy)-N-(4-oxo-2-thioxo-1H-quinazolin-3-yl)pentanamide CAS Name: (2R)-2-(4-bromophenoxy)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide IUPAC Name: (2R)-2-(4-bromophenoxy)-N-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)pentanamide Traditional Name: (2R)-2-(4-bromophenoxy)-N-(4-keto-2-thioxo-1H-quinazolin-3-yl)valeramide Formula: C19H18BrN3O3S MolecularWeight: 448.33352

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NN1C(=O)C2=CC=CC=C2NC1=S)OC3=CC=C(C=C3)Br

Isomeric SMILES

CCC[C@H](C(=O)NN1C(=O)C2=CC=CC=C2NC1=S)OC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H18BrN3O3S/c1-2-5-16(26-13-10-8-12(20)9-11-13)17(24)22-23-18(25)14-6-3-4-7-15(14)21-19(23)27/h3-4,6-11,16H,2,5H2,1H3,(H,21,27)(H,22,24)/t16-/m1/s1