1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenylimidazol-1-yl)propoxy]phenyl]urea

Systemtic Name: 1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenylimidazol-1-yl)propoxy]phenyl]urea Openeye Name: 1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenylimidazol-1-yl)propoxy]phenyl]urea CAS Name: 1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenyl-1-imidazolyl)propoxy]phenyl]urea IUPAC Name: 1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenylimidazol-1-yl)propoxy]phenyl]urea Traditional Name: 1-cyclohexyl-3-[2-(dimethylamino)-6-[3-(4-phenylimidazol-1-yl)propoxy]phenyl]urea Formula: C27H35N5O2 MolecularWeight: 461.5991

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C(=CC=C1)OCCCN2C=C(N=C2)C3=CC=CC=C3)NC(=O)NC4CCCCC4

Isomeric SMILES

CN(C)C1=C(C(=CC=C1)OCCCN2C=C(N=C2)C3=CC=CC=C3)NC(=O)NC4CCCCC4

InChI

InChI=1S/C27H35N5O2/c1-31(2)24-15-9-16-25(26(24)30-27(33)29-22-13-7-4-8-14-22)34-18-10-17-32-19-23(28-20-32)21-11-5-3-6-12-21/h3,5-6,9,11-12,15-16,19-20,22H,4,7-8,10,13-14,17-18H2,1-2H3,(H2,29,30,33)