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

Systemtic Name: 1-(6-azanylhexyl)-3-(3-bromophenyl)-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea Openeye Name: 1-(6-aminohexyl)-3-(3-bromophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea CAS Name: 1-(6-aminohexyl)-3-(3-bromophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea IUPAC Name: 1-(6-aminohexyl)-3-(3-bromophenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea Traditional Name: 1-(6-aminohexyl)-3-(3-bromophenyl)-1-[1-(4-keto-1H-quinazolin-2-yl)ethyl]urea Formula: C23H28BrN5O2 MolecularWeight: 486.40472

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCCN)C(=O)NC3=CC(=CC=C3)Br

Isomeric SMILES

CC(C1=NC(=O)C2=CC=CC=C2N1)N(CCCCCCN)C(=O)NC3=CC(=CC=C3)Br

InChI

InChI=1S/C23H28BrN5O2/c1-16(21-27-20-12-5-4-11-19(20)22(30)28-21)29(14-7-3-2-6-13-25)23(31)26-18-10-8-9-17(24)15-18/h4-5,8-12,15-16H,2-3,6-7,13-14,25H2,1H3,(H,26,31)(H,27,28,30)