6-acetamido-2-[4-[1-ethanoyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutanoylamino]hexanoic acid

Systemtic Name: 6-acetamido-2-[4-[1-ethanoyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutanoylamino]hexanoic acid Openeye Name: 6-acetamido-2-[4-[1-acetyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutanoylamino]hexanoic acid CAS Name: 6-acetamido-2-[[4-[[1-acetyl-4,5-bis(4-methoxyphenyl)-2-imidazolyl]thio]-1-oxobutyl]amino]hexanoic acid IUPAC Name: 6-acetamido-2-[4-[1-acetyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]sulfanylbutanoylamino]hexanoic acid Traditional Name: 6-acetamido-2-[4-[[1-acetyl-4,5-bis(4-methoxyphenyl)imidazol-2-yl]thio]butanoylamino]hexanoic acid Formula: C31H38N4O7S MolecularWeight: 610.72102

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCCCC(C(=O)O)NC(=O)CCCSC1=NC(=C(N1C(=O)C)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

Isomeric SMILES

CC(=O)NCCCCC(C(=O)O)NC(=O)CCCSC1=NC(=C(N1C(=O)C)C2=CC=C(C=C2)OC)C3=CC=C(C=C3)OC

InChI

InChI=1S/C31H38N4O7S/c1-20(36)32-18-6-5-8-26(30(39)40)33-27(38)9-7-19-43-31-34-28(22-10-14-24(41-3)15-11-22)29(35(31)21(2)37)23-12-16-25(42-4)17-13-23/h10-17,26H,5-9,18-19H2,1-4H3,(H,32,36)(H,33,38)(H,39,40)