Vitas-M small molecule compound
methyl N-{[2-({N-[(benzyloxy)carbonyl]-beta-alanyl}amino)-5-bromophenyl](phenyl)methyl}glycinate
Catalog ID
STK700807
SMILES COC(=O)CNC(c1cc(Br)ccc1NC(=O)CCNC(=O)OCc1ccccc1)c1ccccc1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C27H28BrN3O5 MW 554.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28BrN3O5/c1-35-25(33)17-30-26(20-10-6-3-7-11-20)22-16-21(28)12-13-23(22)31-24(32)14-15-29-27(34)36-18-19-8-4-2-5-9-19/h2-13,16,26,30H,14-15,17-18H2,1H3,(H,29,34)(H,31,32)InChIKey
FPLXBTKFDZPYMU-UHFFFAOYSA-NSynonyms
COC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NC(=O)CCNC(=O)OCC3=CC=CC=C3
InChI=1SC27H28BrN3O5c13525(33)173026(20106371120)221621(28)121323(22)3124(32)14152927(34)3618198425919h213162630H14151718H21H3(H2934)(H3132)
methyl2(((2(3(((benzyloxy)carbonyl)amino)propanamido)5bromophenyl)(phenyl)methyl)amino)acetate
METHYL2(((5BROMO2(3((PHENYLMETHOXY)CARBONYLAMINO)PROPANOYLAMINO)PHENYL)PHENYLMETHYL)AMINO)ACETATE
METHYL2(((5BROMO2(3(PHENYLMETHOXYCARBONYLAMINO)PROPANOYLAMINO)PHENYL)PHENYLMETHYL)AMINO)ACETATE
methylN((2((N((benzyloxy)carbonyl)betaalanyl)amino)5bromophenyl)(phenyl)methyl)glycinate
MFCD00525030
ZINC000004258502
ZINC000004258506
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