Vitas-M small molecule compound
4-(pyrimidin-2-ylamino)-N-[3-(4H-1,2,4-triazol-3-yl)phenyl]butanamide
Catalog ID
STL319143
SMILES O=C(Nc1cccc(c1)c1nnc[nH]1)CCCNc1ncccn1
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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 C16H17N7O MW 323.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N7O/c24-14(6-2-7-17-16-18-8-3-9-19-16)22-13-5-1-4-12(10-13)15-20-11-21-23-15/h1,3-5,8-11H,2,6-7H2,(H,22,24)(H,17,18,19)(H,20,21,23)InChIKey
BKBFLBDKLIXLJV-UHFFFAOYSA-NSynonyms
1401579-74-51401579745
4(pyrimidin2ylamino)N(3(1H124triazol5yl)phenyl)butanamide
4(pyrimidin2ylamino)N(3(4H124triazol3yl)phenyl)butanamide
C1=CC(=CC(=C1)NC(=O)CCCNC2=NC=CC=N2)C3=NC=NN3
InChI=1SC16H17N7Oc2414(6271716188391916)221351412(1013)152011212315h135811H267H2(H2224)(H171819)(H202123)
MFCD28031688
N(3(1H124triazol3yl)phenyl)4(pyrimidin2ylamino)butanamide
O=C(Nc1cccc(c1)c1n(nH)cn1)CCCNc1ncccn1
O=C(Nc1cccc(c1)c1nnc(nH)1)CCCNc1ncccn1
ZINC000079476882
ZINC79476882
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