Vitas-M small molecule compound
2-(1H-benzotriazol-1-yl)-N-{2-[(2,4-dimethoxyphenyl)amino]-2-oxo-1-phenylethyl}-N-(2-fluorobenzyl)acetamide
Catalog ID
STL446950
SMILES COc1ccc(c(c1)OC)NC(=O)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1F)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 C31H28FN5O4 MW 553.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28FN5O4/c1-40-23-16-17-26(28(18-23)41-2)33-31(39)30(21-10-4-3-5-11-21)36(19-22-12-6-7-13-24(22)32)29(38)20-37-27-15-9-8-14-25(27)34-35-37/h3-18,30H,19-20H2,1-2H3,(H,33,39)InChIKey
TVSQLPSYVYBZMS-UHFFFAOYSA-NSynonyms
2((2(BENZOTRIAZOL1YL)ACETYL)((2FLUOROPHENYL)METHYL)AMINO)N(24DIMETHOXYPHENYL)2PHENYLACETAMIDE
2(1Hbenzotriazol1yl)N(2((24dimethoxyphenyl)amino)2oxo1phenylethyl)N(2fluorobenzyl)acetamide
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(2FLUOROBENZYL)ACETAMIDO)N(24DIMETHOXYPHENYL)2PHENYLACETAMIDE
COC1=CC(=C(C=C1)NC(=O)C(C2=CC=CC=C2)N(CC3=CC=CC=C3F)C(=O)CN4C5=CC=CC=C5N=N4)OC
InChI=1SC31H28FN5O4c14023161726(28(1823)412)3331(39)30(21104351121)36(192212671324(22)32)29(38)20372715981425(27)343537h31830H1920H212H3(H3339)
MFCD06244497
ZINC000001419100
ZINC000001419101
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