2-[4-(butylamino)quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)butanamide

Systemtic Name: 2-[4-(butylamino)quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)butanamide Openeye Name: 2-[4-(butylamino)quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)butanamide CAS Name: 2-[[4-(butylamino)-2-quinazolinyl]thio]-N-(3-methoxypropyl)butanamide IUPAC Name: 2-[4-(butylamino)quinazolin-2-yl]sulfanyl-N-(3-methoxypropyl)butanamide Traditional Name: 2-[[4-(butylamino)quinazolin-2-yl]thio]-N-(3-methoxypropyl)butyramide Formula: C20H30N4O2S MolecularWeight: 390.5428

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC2=CC=CC=C21)SC(CC)C(=O)NCCCOC

Isomeric SMILES

CCCCNC1=NC(=NC2=CC=CC=C21)SC(CC)C(=O)NCCCOC

InChI

InChI=1S/C20H30N4O2S/c1-4-6-12-21-18-15-10-7-8-11-16(15)23-20(24-18)27-17(5-2)19(25)22-13-9-14-26-3/h7-8,10-11,17H,4-6,9,12-14H2,1-3H3,(H,22,25)(H,21,23,24)