Vitas-M small molecule compound

N~3~-(4,6-dimethylpyrimidin-2-yl)-N-4H-1,2,4-triazol-3-yl-beta-alaninamide

Catalog ID
STL318165
SMILES O=C(Nc1nnc[nH]1)CCNc1nc(C)cc(n1)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 C11H15N7O MW 261.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H15N7O/c1-7-5-8(2)16-10(15-7)12-4-3-9(19)17-11-13-6-14-18-11/h5-6H,3-4H2,1-2H3,(H,12,15,16)(H2,13,14,17,18,19)
InChIKey
YTEMWKVOIUVPRK-UHFFFAOYSA-N
Synonyms
1435982-07-2
1435982072
3((46dimethylpyrimidin2yl)amino)N(1H124triazol3yl)propanamide
3((46dimethylpyrimidin2yl)amino)N(1H124triazol5yl)propanamide
CC1=CC(=NC(=N1)NCCC(=O)NC2=NC=NN2)C
InChI=1SC11H15N7Oc1758(2)1610(157)12439(19)1711136141811h56H34H212H3(H121516)(H21314171819)
MFCD28031134
N~3~(46dimethylpyrimidin2yl)N4H124triazol3ylbetaalaninamide
N3(46DIMETHYLPYRIMIDIN2YL)N4H124TRIAZOL3YLBETAALANINAMIDE
O=C(Nc1n(nH)cn1)CCNc1nc(C)cc(n1)C
O=C(Nc1nnc(nH)1)CCNc1nc(C)cc(n1)C
ZINC000095479083
ZINC95479083

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Available files

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