Vitas-M small molecule compound

(2E)-N-(3-chlorophenyl)-2-cyano-3-[3-methoxy-4-(pentyloxy)phenyl]prop-2-enamide

Catalog ID
STK949925
SMILES CCCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1cccc(c1)Cl)\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 C22H23ClN2O3 MW 398.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23ClN2O3/c1-3-4-5-11-28-20-10-9-16(13-21(20)27-2)12-17(15-24)22(26)25-19-8-6-7-18(23)14-19/h6-10,12-14H,3-5,11H2,1-2H3,(H,25,26)/b17-12+
InChIKey
OCWUGSLBMFDFAU-SFQUDFHCSA-N
Synonyms

(2E)N(3chlorophenyl)2cyano3(3methoxy4(pentyloxy)phenyl)prop2enamide
(2E)N(3CHLOROPHENYL)2CYANO3(3METHOXY4PENTYLOXYPHENYL)PROP2ENAMIDE
(E)N(3CHLOROPHENYL)2CYANO3(3METHOXY4PENTOXYPHENYL)PROP2ENAMIDE
CCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC(=CC=C2)Cl)OC
CCCCCOc1ccc(cc1OC)C=C(C(=O)Nc1cccc(c1)Cl)C#N
InChI=1SC22H23ClN2O3c134511282010916(1321(20)272)1217(1524)22(26)251986718(23)1419h6101214H3511H212H3(H2526)b1712+
MFCD02957123
ZINC000002670467
ZINC02670467
ZINC2670467

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Available files

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