Vitas-M small molecule compound

N-[3-(2-methylpropyl)-1H-1,2,4-triazol-5-yl]-N~3~-pyrimidin-2-yl-beta-alaninamide

Catalog ID
STL318647
SMILES CC(Cc1n[nH]c(n1)NC(=O)CCNc1ncccn1)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 C13H19N7O MW 289.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H19N7O/c1-9(2)8-10-17-13(20-19-10)18-11(21)4-7-16-12-14-5-3-6-15-12/h3,5-6,9H,4,7-8H2,1-2H3,(H,14,15,16)(H2,17,18,19,20,21)
InChIKey
ZOHPRICDKMSNHO-UHFFFAOYSA-N
Synonyms
1435999-83-9
1435999839
CC(C)CC1=NC(=NN1)NC(=O)CCNC2=NC=CC=N2
CC(Cc1(nH)nc(n1)NC(=O)CCNc1ncccn1)C
CC(Cc1n(nH)c(n1)NC(=O)CCNc1ncccn1)C
InChI=1SC13H19N7Oc19(2)8101713(201910)1811(21)471612145361512h3569H478H212H3(H141516)(H21718192021)
MFCD28031409
N(3(2methylpropyl)1H124triazol5yl)N~3~pyrimidin2ylbetaalaninamide
N(3(2METHYLPROPYL)1H124TRIAZOL5YL)N3PYRIMIDIN2YLBETAALANINAMIDE
N(5(2methylpropyl)1H124triazol3yl)3(pyrimidin2ylamino)propanamide
N(5isobutyl1H124triazol3yl)3(pyrimidin2ylamino)propanamide
ZINC000095479466
ZINC95479466

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Available files

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