Vitas-M small molecule compound
methyl N-{[2-({N-[(benzyloxy)carbonyl]alanyl}amino)-5-bromophenyl](phenyl)methyl}glycinate
Catalog ID
STL026580
SMILES COC(=O)CNC(c1cc(Br)ccc1NC(=O)C(NC(=O)OCc1ccccc1)C)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/c1-18(30-27(34)36-17-19-9-5-3-6-10-19)26(33)31-23-14-13-21(28)15-22(23)25(29-16-24(32)35-2)20-11-7-4-8-12-20/h3-15,18,25,29H,16-17H2,1-2H3,(H,30,34)(H,31,33)InChIKey
HZJPNHBSXHUMGE-UHFFFAOYSA-NSynonyms
CC(C(=O)NC1=C(C=C(C=C1)Br)C(C2=CC=CC=C2)NCC(=O)OC)NC(=O)OCC3=CC=CC=C3
InChI=1SC27H28BrN3O5c118(3027(34)36171995361019)26(33)3123141321(28)1522(23)25(291624(32)352)20117481220h315182529H1617H212H3(H3034)(H3133)
methyl2(((2(2(((benzyloxy)carbonyl)amino)propanamido)5bromophenyl)(phenyl)methyl)amino)acetate
METHYL2(((5BROMO2(2(PHENYLMETHOXYCARBONYLAMINO)PROPANOYLAMINO)PHENYL)PHENYLMETHYL)AMINO)ACETATE
methylN((2((N((benzyloxy)carbonyl)alanyl)amino)5bromophenyl)(phenyl)methyl)glycinate
MFCD00525028
ZINC000102899914
ZINC000102899920
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