Vitas-M small molecule compound
(2E)-3-[4-(propan-2-yl)phenyl]-N-(1H-tetrazol-5-yl)prop-2-enamide
Catalog ID
STK439022
SMILES O=C(Nc1nnn[nH]1)/C=C/c1ccc(cc1)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 C13H15N5O MW 257.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N5O/c1-9(2)11-6-3-10(4-7-11)5-8-12(19)14-13-15-17-18-16-13/h3-9H,1-2H3,(H2,14,15,16,17,18,19)/b8-5+InChIKey
OUQJUQDRHRVMFL-VMPITWQZSA-NSynonyms
(2E)3(4(propan2yl)phenyl)N(1Htetrazol5yl)prop2enamide
(E)3(4PROPAN2YLPHENYL)N(2HTETRAZOL5YL)PROP2ENAMIDE
3(4ISOPROPYLPHENYL)N1HTETRAZOL5YLACRYLAMIDE
CC(C)C1=CC=C(C=C1)C=CC(=O)NC2=NNN=N2
InChI=1SC13H15N5Oc19(2)116310(4711)5812(19)14131517181613h39H12H3(H2141516171819)b85+
MFCD03364573
O=C(Nc1nnn(nH)1)C=Cc1ccc(cc1)C(C)C
ZINC000007009302
ZINC7009302
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