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

Systemtic Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylsulfanyl]phenyl]-3-pentyl-urea Openeye Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylsulfanyl]phenyl]-3-pentyl-urea CAS Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-1-imidazolyl)propylthio]phenyl]-3-pentylurea IUPAC Name: 1-[2-(dimethylamino)-6-[3-(5-methyl-4-phenylimidazol-1-yl)propylsulfanyl]phenyl]-3-pentylurea Traditional Name: 1-amyl-3-[2-(dimethylamino)-6-[3-(5-methyl-4-phenyl-imidazol-1-yl)propylthio]phenyl]urea Formula: C27H37N5OS MolecularWeight: 479.68058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C=CC=C1SCCCN2C=NC(=C2C)C3=CC=CC=C3)N(C)C

Isomeric SMILES

CCCCCNC(=O)NC1=C(C=CC=C1SCCCN2C=NC(=C2C)C3=CC=CC=C3)N(C)C

InChI

InChI=1S/C27H37N5OS/c1-5-6-10-17-28-27(33)30-26-23(31(3)4)15-11-16-24(26)34-19-12-18-32-20-29-25(21(32)2)22-13-8-7-9-14-22/h7-9,11,13-16,20H,5-6,10,12,17-19H2,1-4H3,(H2,28,30,33)