1-[2-methyl-6-[3-[4-(2-methylsulfonylphenyl)imidazol-1-yl]propoxy]phenyl]-3-pentyl-urea

Systemtic Name: 1-[2-methyl-6-[3-[4-(2-methylsulfonylphenyl)imidazol-1-yl]propoxy]phenyl]-3-pentyl-urea Openeye Name: 1-[2-methyl-6-[3-[4-(2-methylsulfonylphenyl)imidazol-1-yl]propoxy]phenyl]-3-pentyl-urea CAS Name: 1-[2-methyl-6-[3-[4-(2-methylsulfonylphenyl)-1-imidazolyl]propoxy]phenyl]-3-pentylurea IUPAC Name: 1-[2-methyl-6-[3-[4-(2-methylsulfonylphenyl)imidazol-1-yl]propoxy]phenyl]-3-pentylurea Traditional Name: 1-amyl-3-[2-[3-[4-(2-mesylphenyl)imidazol-1-yl]propoxy]-6-methyl-phenyl]urea Formula: C26H34N4O4S MolecularWeight: 498.63756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)NC1=C(C=CC=C1OCCCN2C=C(N=C2)C3=CC=CC=C3S(=O)(=O)C)C

Isomeric SMILES

CCCCCNC(=O)NC1=C(C=CC=C1OCCCN2C=C(N=C2)C3=CC=CC=C3S(=O)(=O)C)C

InChI

InChI=1S/C26H34N4O4S/c1-4-5-8-15-27-26(31)29-25-20(2)11-9-13-23(25)34-17-10-16-30-18-22(28-19-30)21-12-6-7-14-24(21)35(3,32)33/h6-7,9,11-14,18-19H,4-5,8,10,15-17H2,1-3H3,(H2,27,29,31)