Vitas-M small molecule compound
N-[2-(1,3-benzodioxol-5-ylamino)-1-(4-fluorophenyl)-2-oxoethyl]-2-(1H-benzotriazol-1-yl)-N-(pyridin-3-ylmethyl)acetamide
Catalog ID
STL446884
SMILES Fc1ccc(cc1)C(N(C(=O)Cn1nnc2c1cccc2)Cc1cccnc1)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 C29H23FN6O4 MW 538.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H23FN6O4/c30-21-9-7-20(8-10-21)28(29(38)32-22-11-12-25-26(14-22)40-18-39-25)35(16-19-4-3-13-31-15-19)27(37)17-36-24-6-2-1-5-23(24)33-34-36/h1-15,28H,16-18H2,(H,32,38)InChIKey
DXXUYGATJHSIGZ-UHFFFAOYSA-NSynonyms
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(PYRIDIN3YLMETHYL)ACETAMIDO)N(BENZO(D)(13)DIOXOL5YL)2(4FLUOROPHENYL)ACETAMIDE
C1OC2=C(O1)C=C(C=C2)NC(=O)C(C3=CC=C(C=C3)F)N(CC4=CN=CC=C4)C(=O)CN5C6=CC=CC=C6N=N5
InChI=1SC29H23FN6O4c30219720(81021)28(29(38)322211122526(1422)40183925)35(16194313311519)27(37)173624621523(24)333436h11528H1618H2(H3238)
MFCD07773309
N(13BENZODIOXOL5YL)2((2(BENZOTRIAZOL1YL)ACETYL)(PYRIDIN3YLMETHYL)AMINO)2(4FLUOROPHENYL)ACETAMIDE
N(2(13benzodioxol5ylamino)1(4fluorophenyl)2oxoethyl)2(1Hbenzotriazol1yl)N(pyridin3ylmethyl)acetamide
ZINC000001419057
ZINC000001419058
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