2-(4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N,N'-bis(phenylmethyl)propanediamide

Systemtic Name: 2-(4-oxidanylidene-3-pentyl-quinazolin-2-yl)sulfanyl-N,N'-bis(phenylmethyl)propanediamide Openeye Name: N,N'-dibenzyl-2-(4-oxo-3-pentyl-quinazolin-2-yl)sulfanyl-propanediamide CAS Name: 2-[(4-oxo-3-pentyl-2-quinazolinyl)thio]-N,N'-bis(phenylmethyl)propanediamide IUPAC Name: N,N'-dibenzyl-2-(4-oxo-3-pentylquinazolin-2-yl)sulfanylpropanediamide Traditional Name: 2-[(3-amyl-4-keto-quinazolin-2-yl)thio]-N,N'-dibenzyl-malonamide Formula: C30H32N4O3S MolecularWeight: 528.66508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2N=C1SC(C(=O)NCC3=CC=CC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C30H32N4O3S/c1-2-3-12-19-34-29(37)24-17-10-11-18-25(24)33-30(34)38-26(27(35)31-20-22-13-6-4-7-14-22)28(36)32-21-23-15-8-5-9-16-23/h4-11,13-18,26H,2-3,12,19-21H2,1H3,(H,31,35)(H,32,36)