Vitas-M small molecule compound
N~2~-(1H-benzotriazol-1-ylacetyl)-N~2~-(2-fluorobenzyl)-N-[4-(morpholin-4-yl)phenyl]valinamide
Catalog ID
STL437527
SMILES CC(C(N(C(=O)Cn1nnc2c1cccc2)Cc1ccccc1F)C(=O)Nc1ccc(cc1)N1CCOCC1)C
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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 C30H33FN6O3 MW 544.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33FN6O3/c1-21(2)29(30(39)32-23-11-13-24(14-12-23)35-15-17-40-18-16-35)36(19-22-7-3-4-8-25(22)31)28(38)20-37-27-10-6-5-9-26(27)33-34-37/h3-14,21,29H,15-20H2,1-2H3,(H,32,39)InChIKey
XVBKQQFXJWRUDC-UHFFFAOYSA-NSynonyms
2((2(BENZOTRIAZOL1YL)ACETYL)((2FLUOROPHENYL)METHYL)AMINO)3METHYLN(4MORPHOLIN4YLPHENYL)BUTANAMIDE
2(2(1HBENZO(D)(123)TRIAZOL1YL)N(2FLUOROBENZYL)ACETAMIDO)3METHYLN(4MORPHOLINOPHENYL)BUTANAMIDE
CC(C)C(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N(CC3=CC=CC=C3F)C(=O)CN4C5=CC=CC=C5N=N4
InChI=1SC30H33FN6O3c121(2)29(30(39)3223111324(141223)35151740181635)36(1922734825(22)31)28(38)2037271065926(27)333437h3142129H1520H212H3(H3239)
MFCD07773123
N~2~(1Hbenzotriazol1ylacetyl)N~2~(2fluorobenzyl)N(4(morpholin4yl)phenyl)valinamide
ZINC000008694406
ZINC000008694407
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