1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylamino]phenyl]-3-pentyl-urea

Systemtic Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylamino]phenyl]-3-pentyl-urea Openeye Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylamino]phenyl]-3-pentyl-urea CAS Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-1-imidazolyl)propylamino]phenyl]-3-pentylurea IUPAC Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenylimidazol-1-yl)propylamino]phenyl]-3-pentylurea Traditional Name: 1-amyl-3-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylamino]phenyl]urea Formula: C27H38N6O MolecularWeight: 462.63022

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C=CC=C1N(C)C)NCCCN2C=NC(=C2C)C3=CC=CC=C3

Isomeric SMILES

CCCCCNC(=O)NC1=C(C=CC=C1N(C)C)NCCCN2C=NC(=C2C)C3=CC=CC=C3

InChI

InChI=1S/C27H38N6O/c1-5-6-10-17-29-27(34)31-26-23(15-11-16-24(26)32(3)4)28-18-12-19-33-20-30-25(21(33)2)22-13-8-7-9-14-22/h7-9,11,13-16,20,28H,5-6,10,12,17-19H2,1-4H3,(H2,29,31,34)