CHEBI:47490 - CIS-[4,5-BIS-(4-BROMOPHENYL)-2-(2-ETHOXY-4-METHOXYPHENYL)-4,5-DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHANONE

ChEBI IDCHEBI:47490
ChEBI NameCIS-[4,5-BIS-(4-BROMOPHENYL)-2-(2-ETHOXY-4-METHOXYPHENYL)-4,5-DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHANONE
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Last Modified17 October 2009
DownloadsMolfile
FormulaC31H34Br2N4O4
Net Charge0
Average Mass686.445
Monoisotopic Mass684.09468
SMILES[H]OC([H])([H])C([H])([H])N1C([H])([H])C([H])([H])N(C(=O)N2C(c3c([H])c([H])c(OC([H])([H])[H])c([H])c3OC([H])([H])C([H])([H])[H])=N[C@@]([H])(c3c([H])c([H])c(Br)c([H])c3[H])[C@@]2([H])c2c([H])c([H])c(Br)c([H])c2[H])C([H])([H])C1([H])[H]
InChIInChI=1S/C31H34Br2N4O4/c1-3-41-27-20-25(40-2)12-13-26(27)30-34-28(21-4-8-23(32)9-5-21)29(22-6-10-24(33)11-7-22)37(30)31(39)36-16-14-35(15-17-36)18-19-38/h4-13,20,28-29,38H,3,14-19H2,1-2H3/t28-,29+/m0/s1
InChIKeyPVRYEWOXWGDQHA-URLMMPGGSA-N
ChEBI Ontology
Outgoing Relation(s)
CIS-[4,5-BIS-(4-BROMOPHENYL)-2-(2-ETHOXY-4-METHOXYPHENYL)-4,5-DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHANONE (CHEBI:47490) is a unclassifieds (CHEBI:27189)
Synonyms  Source
2-(4-{[(4S,5R)-4,5-bis(4-bromophenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl]carbonyl}piperazin-1-yl)ethanolPDBeChem
CIS-[4,5-BIS-(4-BROMOPHENYL)-2-(2-ETHOXY-4-METHOXYPHENYL)-4,5-DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHANONEPDBeChem
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