2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[4-oxidanylidene-3-(phenylmethyl)quinazolin-2-yl]sulfanyl-N-pentan-3-yl-ethanamide Openeye Name: 2-(3-benzyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(1-ethylpropyl)acetamide CAS Name: 2-[[4-oxo-3-(phenylmethyl)-2-quinazolinyl]thio]-N-pentan-3-ylacetamide IUPAC Name: 2-(3-benzyl-4-oxoquinazolin-2-yl)sulfanyl-N-pentan-3-ylacetamide Traditional Name: 2-[(3-benzyl-4-keto-quinazolin-2-yl)thio]-N-(1-ethylpropyl)acetamide Formula: C22H25N3O2S MolecularWeight: 395.5178

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

Isomeric SMILES

CCC(CC)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O2S/c1-3-17(4-2)23-20(26)15-28-22-24-19-13-9-8-12-18(19)21(27)25(22)14-16-10-6-5-7-11-16/h5-13,17H,3-4,14-15H2,1-2H3,(H,23,26)