2-[7-(furan-2-ylmethylcarbamoyl)-4-oxidanylidene-3-pentyl-quinazolin-2-yl]sulfanyl-N,N'-bis(phenylmethyl)propanediamide

Systemtic Name: 2-[7-(furan-2-ylmethylcarbamoyl)-4-oxidanylidene-3-pentyl-quinazolin-2-yl]sulfanyl-N,N'-bis(phenylmethyl)propanediamide Openeye Name: N,N'-dibenzyl-2-[7-(2-furylmethylcarbamoyl)-4-oxo-3-pentyl-quinazolin-2-yl]sulfanyl-propanediamide CAS Name: 2-[[7-[(2-furanylmethylamino)-oxomethyl]-4-oxo-3-pentyl-2-quinazolinyl]thio]-N,N'-bis(phenylmethyl)propanediamide IUPAC Name: N,N'-dibenzyl-2-[7-(furan-2-ylmethylcarbamoyl)-4-oxo-3-pentylquinazolin-2-yl]sulfanylpropanediamide Traditional Name: 2-[[3-amyl-7-(2-furfurylcarbamoyl)-4-keto-quinazolin-2-yl]thio]-N,N'-dibenzyl-malonamide Formula: C36H37N5O5S MolecularWeight: 651.77448

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)N=C1SC(C(=O)NCC4=CC=CC=C4)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CCCCCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)N=C1SC(C(=O)NCC4=CC=CC=C4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C36H37N5O5S/c1-2-3-10-19-41-35(45)29-18-17-27(32(42)39-24-28-16-11-20-46-28)21-30(29)40-36(41)47-31(33(43)37-22-25-12-6-4-7-13-25)34(44)38-23-26-14-8-5-9-15-26/h4-9,11-18,20-21,31H,2-3,10,19,22-24H2,1H3,(H,37,43)(H,38,44)(H,39,42)