5-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-[2-(phenylmethylsulfanyl)ethyl]pentanamide

Systemtic Name: 5-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-N-[2-(phenylmethylsulfanyl)ethyl]pentanamide Openeye Name: N-(2-benzylsulfanylethyl)-5-(2,4-dioxo-1H-quinazolin-3-yl)pentanamide CAS Name: 5-(2,4-dioxo-1H-quinazolin-3-yl)-N-[2-(phenylmethylthio)ethyl]pentanamide IUPAC Name: N-(2-benzylsulfanylethyl)-5-(2,4-dioxo-1H-quinazolin-3-yl)pentanamide Traditional Name: N-[2-(benzylthio)ethyl]-5-(2,4-diketo-1H-quinazolin-3-yl)valeramide Formula: C22H25N3O3S MolecularWeight: 411.5172

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSCCNC(=O)CCCCN2C(=O)C3=CC=CC=C3NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CSCCNC(=O)CCCCN2C(=O)C3=CC=CC=C3NC2=O

InChI

InChI=1S/C22H25N3O3S/c26-20(23-13-15-29-16-17-8-2-1-3-9-17)12-6-7-14-25-21(27)18-10-4-5-11-19(18)24-22(25)28/h1-5,8-11H,6-7,12-16H2,(H,23,26)(H,24,28)