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

Systemtic Name: 2-[7-(furan-2-ylmethylcarbamoyl)-4-oxidanylidene-3-prop-2-enyl-quinazolin-2-yl]sulfanyl-N,N'-bis(phenylmethyl)propanediamide Openeye Name: 2-[3-allyl-7-(2-furylmethylcarbamoyl)-4-oxo-quinazolin-2-yl]sulfanyl-N,N'-dibenzyl-propanediamide CAS Name: 2-[[7-[(2-furanylmethylamino)-oxomethyl]-4-oxo-3-prop-2-enyl-2-quinazolinyl]thio]-N,N'-bis(phenylmethyl)propanediamide IUPAC Name: N,N'-dibenzyl-2-[7-(furan-2-ylmethylcarbamoyl)-4-oxo-3-prop-2-enylquinazolin-2-yl]sulfanylpropanediamide Traditional Name: 2-[[3-allyl-7-(2-furfurylcarbamoyl)-4-keto-quinazolin-2-yl]thio]-N,N'-dibenzyl-malonamide Formula: C34H31N5O5S MolecularWeight: 621.70544

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=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

C=CCN1C(=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/C34H31N5O5S/c1-2-17-39-33(43)27-16-15-25(30(40)37-22-26-14-9-18-44-26)19-28(27)38-34(39)45-29(31(41)35-20-23-10-5-3-6-11-23)32(42)36-21-24-12-7-4-8-13-24/h2-16,18-19,29H,1,17,20-22H2,(H,35,41)(H,36,42)(H,37,40)