1-(6-azanylhexyl)-3-butyl-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea

Systemtic Name: 1-(6-azanylhexyl)-3-butyl-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea Openeye Name: 1-(6-aminohexyl)-3-butyl-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea CAS Name: 1-(6-aminohexyl)-3-butyl-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea IUPAC Name: 1-(6-aminohexyl)-3-butyl-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea Traditional Name: 1-(6-aminohexyl)-3-butyl-1-[1-(4-keto-1H-quinazolin-2-yl)ethyl]urea Formula: C21H33N5O2 MolecularWeight: 387.51902

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(CCCCCCN)C(C)C1=NC(=O)C2=CC=CC=C2N1

Isomeric SMILES

CCCCNC(=O)N(CCCCCCN)C(C)C1=NC(=O)C2=CC=CC=C2N1

InChI

InChI=1S/C21H33N5O2/c1-3-4-14-23-21(28)26(15-10-6-5-9-13-22)16(2)19-24-18-12-8-7-11-17(18)20(27)25-19/h7-8,11-12,16H,3-6,9-10,13-15,22H2,1-2H3,(H,23,28)(H,24,25,27)