Vitas-M small molecule compound
(2E)-3-(4-tert-butylphenyl)-N-(1H-1,2,4-triazol-3-yl)prop-2-enamide
Catalog ID
STK968442
SMILES O=C(Nc1n[nH]cn1)/C=C/c1ccc(cc1)C(C)(C)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 C15H18N4O MW 270.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O/c1-15(2,3)12-7-4-11(5-8-12)6-9-13(20)18-14-16-10-17-19-14/h4-10H,1-3H3,(H2,16,17,18,19,20)/b9-6+InChIKey
KBHPCFKRKIXTLU-RMKNXTFCSA-NSynonyms
445288-05-1(2E)3(4tertbutylphenyl)N(1H124triazol3yl)prop2enamide
(E)3(4TERTBUTYLPHENYL)N(1H124TRIAZOL5YL)PROP2ENAMIDE
445288051
CC(C)(C)C1=CC=C(C=C1)C=CC(=O)NC2=NC=NN2
InChI=1SC15H18N4Oc115(23)127411(5812)6913(20)18141610171914h410H13H3(H21617181920)b96+
MFCD02371783
O=C(Nc1n(nH)cn1)C=Cc1ccc(cc1)C(C)(C)C
ZINC000000461367
ZINC461367
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