Vitas-M small molecule compound

N-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-1-(3,4,5-trimethoxyphenyl)ethyl]-2-(1H-benzotriazol-1-yl)-N-(4-fluorobenzyl)acetamide

Catalog ID
STL446755
SMILES COc1c(OC)cc(cc1OC)C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccc(cc1)F)C(=O)Nc1ccc2c(c1)OCO2

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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 C33H30FN5O7 MW 627.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H30FN5O7/c1-42-28-14-21(15-29(43-2)32(28)44-3)31(33(41)35-23-12-13-26-27(16-23)46-19-45-26)38(17-20-8-10-22(34)11-9-20)30(40)18-39-25-7-5-4-6-24(25)36-37-39/h4-16,31H,17-19H2,1-3H3,(H,35,41)
InChIKey
RLIAZZFCOGDUSQ-UHFFFAOYSA-N
Synonyms

2(2(1HBENZO(D)(123)TRIAZOL1YL)N(4FLUOROBENZYL)ACETAMIDO)N(BENZO(D)(13)DIOXOL5YL)2(345TRIMETHOXYPHENYL)ACETAMIDE
COC1=CC(=CC(=C1OC)OC)C(C(=O)NC2=CC3=C(C=C2)OCO3)N(CC4=CC=C(C=C4)F)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC33H30FN5O7c142281421(1529(432)32(28)443)31(33(41)352312132627(1623)46194526)38(172081022(34)11920)30(40)183925754624(25)363739h41631H1719H213H3(H3541)
MFCD06244372
N(13BENZODIOXOL5YL)2((2(BENZOTRIAZOL1YL)ACETYL)((4FLUOROPHENYL)METHYL)AMINO)2(345TRIMETHOXYPHENYL)ACETAMIDE
N(2(13benzodioxol5ylamino)2oxo1(345trimethoxyphenyl)ethyl)2(1Hbenzotriazol1yl)N(4fluorobenzyl)acetamide
ZINC000008713023
ZINC000008713025
ZINC08713023

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Available files

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