Vitas-M small molecule compound
5-amino-3-[(Z)-1-cyano-2-{3-ethoxy-4-[2-(3-methylphenoxy)ethoxy]phenyl}ethenyl]-1-phenyl-1H-pyrazole-4-carbonitrile
Catalog ID
STK020846
SMILES CCOc1cc(ccc1OCCOc1cccc(c1)C)/C=C(/c1nn(c(c1C#N)N)c1ccccc1)\C#N
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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 C30H27N5O3 MW 505.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O3/c1-3-36-28-18-22(12-13-27(28)38-15-14-37-25-11-7-8-21(2)16-25)17-23(19-31)29-26(20-32)30(33)35(34-29)24-9-5-4-6-10-24/h4-13,16-18H,3,14-15,33H2,1-2H3/b23-17+InChIKey
QXUMAXSJZKRLSD-HAVVHWLPSA-NSynonyms
5AMINO3((Z)1CYANO2(3ETHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)ETHENYL)1PHENYL1HPYRAZOLE4CARBONITRILE
5AMINO3((Z)1CYANO2(3ETHOXY4(2(3METHYLPHENOXY)ETHOXY)PHENYL)ETHENYL)1PHENYLPYRAZOLE4CARBONITRILE
CCOC1=C(C=CC(=C1)C=C(C#N)C2=NN(C(=C2C#N)N)C3=CC=CC=C3)OCCOC4=CC=CC(=C4)C
CCOc1cc(ccc1OCCOc1cccc(c1)C)C=C(c1nn(c(c1C#N)N)c1ccccc1)C#N
InChI=1SC30H27N5O3c1336281822(121327(28)3815143725117821(2)1625)1723(1931)2926(2032)30(33)35(3429)2495461024h4131618H3141533H212H3b2317+
MFCD03032641
STK020846
ZINC000009057156
ZINC09057156
ZINC9057156
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