1-[2-[4-[[2-butyl-5-(hydroxymethyl)-4-methylsulfanyl-imidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-propyl-urea

Systemtic Name: 1-[2-[4-[[2-butyl-5-(hydroxymethyl)-4-methylsulfanyl-imidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-propyl-urea Openeye Name: 1-[2-[4-[[2-butyl-5-(hydroxymethyl)-4-methylsulfanyl-imidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-propyl-urea CAS Name: 1-[2-[4-[[2-butyl-5-(hydroxymethyl)-4-(methylthio)-1-imidazolyl]methyl]phenyl]phenyl]sulfonyl-3-propylurea IUPAC Name: 1-[2-[4-[[2-butyl-5-(hydroxymethyl)-4-methylsulfanylimidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-propylurea Traditional Name: 1-[2-[4-[[2-butyl-5-methylol-4-(methylthio)imidazol-1-yl]methyl]phenyl]phenyl]sulfonyl-3-propyl-urea Formula: C26H34N4O4S2 MolecularWeight: 530.70256

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCCC)CO)SC

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)C3=CC=CC=C3S(=O)(=O)NC(=O)NCCC)CO)SC

InChI

InChI=1S/C26H34N4O4S2/c1-4-6-11-24-28-25(35-3)22(18-31)30(24)17-19-12-14-20(15-13-19)21-9-7-8-10-23(21)36(33,34)29-26(32)27-16-5-2/h7-10,12-15,31H,4-6,11,16-18H2,1-3H3,(H2,27,29,32)