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

Systemtic Name: 1-(6-azanylhexyl)-3-(2,6-dimethylphenyl)-1-[1-(4-oxidanylidene-1H-quinazolin-2-yl)ethyl]urea Openeye Name: 1-(6-aminohexyl)-3-(2,6-dimethylphenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea CAS Name: 1-(6-aminohexyl)-3-(2,6-dimethylphenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea IUPAC Name: 1-(6-aminohexyl)-3-(2,6-dimethylphenyl)-1-[1-(4-oxo-1H-quinazolin-2-yl)ethyl]urea Traditional Name: 1-(6-aminohexyl)-3-(2,6-dimethylphenyl)-1-[1-(4-keto-1H-quinazolin-2-yl)ethyl]urea Formula: C25H33N5O2 MolecularWeight: 435.56182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)N(CCCCCCN)C(C)C2=NC(=O)C3=CC=CC=C3N2

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)N(CCCCCCN)C(C)C2=NC(=O)C3=CC=CC=C3N2

InChI

InChI=1S/C25H33N5O2/c1-17-11-10-12-18(2)22(17)28-25(32)30(16-9-5-4-8-15-26)19(3)23-27-21-14-7-6-13-20(21)24(31)29-23/h6-7,10-14,19H,4-5,8-9,15-16,26H2,1-3H3,(H,28,32)(H,27,29,31)