2-[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]butanoylamino]hexanoic acid

Systemtic Name: 2-[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]butanoylamino]hexanoic acid Openeye Name: 2-[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]butanoylamino]hexanoic acid CAS Name: 2-[[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]thio]-1-oxobutyl]amino]hexanoic acid IUPAC Name: 2-[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]sulfanyl]butanoylamino]hexanoic acid Traditional Name: 2-[4-[[4,5-bis(4-methoxyphenyl)-1H-imidazol-2-yl]thio]butanoylamino]hexanoic acid Formula: C27H33N3O5S MolecularWeight: 511.63302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)O)NC(=O)CCCSC1=NC(=C(N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CCCSC1=NC(=C(N1)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H33N3O5S/c1-4-5-7-22(26(32)33)28-23(31)8-6-17-36-27-29-24(18-9-13-20(34-2)14-10-18)25(30-27)19-11-15-21(35-3)16-12-19/h9-16,22H,4-8,17H2,1-3H3,(H,28,31)(H,29,30)(H,32,33)