Vitas-M small molecule compound
2-(1H-benzotriazol-1-yl)-N-(4-fluorobenzyl)-N-{1-(4-methoxyphenyl)-2-[(4-methoxyphenyl)amino]-2-oxoethyl}acetamide
Catalog ID
STL438981
SMILES COc1ccc(cc1)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccc(cc1)F)C(=O)Nc1ccc(cc1)OC
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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/c1-40-25-15-9-22(10-16-25)30(31(39)33-24-13-17-26(41-2)18-14-24)36(19-21-7-11-23(32)12-8-21)29(38)20-37-28-6-4-3-5-27(28)34-35-37/h3-18,30H,19-20H2,1-2H3,(H,33,39)InChIKey
KZPGMYRJENGHTA-UHFFFAOYSA-NSynonyms
2((2(BENZOTRIAZOL1YL)ACETYL)((4FLUOROPHENYL)METHYL)AMINO)N2BIS(4METHOXYPHENYL)ACETAMIDE
2(1Hbenzotriazol1yl)N(4fluorobenzyl)N(1(4methoxyphenyl)2((4methoxyphenyl)amino)2oxoethyl)acetamide
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(4FLUOROBENZYL)ACETAMIDO)N2BIS(4METHOXYPHENYL)ACETAMIDE
COC1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)OC)N(CC3=CC=C(C=C3)F)C(=O)CN4C5=CC=CC=C5N=N4
InChI=1SC31H28FN5O4c1402515922(101625)30(31(39)3324131726(412)181424)36(192171123(32)12821)29(38)203728643527(28)343537h31830H1920H212H3(H3339)
MFCD06244476
ZINC000001419066
ZINC000001419067
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