Vitas-M small molecule compound

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

Catalog ID
STK949930
SMILES CCCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1cccc(c1Cl)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 C22H22Cl2N2O3 MW 433.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22Cl2N2O3/c1-3-4-5-11-29-19-10-9-15(13-20(19)28-2)12-16(14-25)22(27)26-18-8-6-7-17(23)21(18)24/h6-10,12-13H,3-5,11H2,1-2H3,(H,26,27)/b16-12+
InChIKey
KFFDBZUJXFBTQU-FOWTUZBSSA-N
Synonyms

(2E)2cyanoN(23dichlorophenyl)3(3methoxy4(pentyloxy)phenyl)prop2enamide
(2E)N(23DICHLOROPHENYL)2CYANO3(3METHOXY4PENTYLOXYPHENYL)PROP2ENAMIDE
(E)2CYANON(23DICHLOROPHENYL)3(3METHOXY4PENTOXYPHENYL)PROP2ENAMIDE
CCCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=C(C(=CC=C2)Cl)Cl)OC
CCCCCOc1ccc(cc1OC)C=C(C(=O)Nc1cccc(c1Cl)Cl)C#N
InChI=1SC22H22Cl2N2O3c134511291910915(1320(19)282)1216(1425)22(27)261886717(23)21(18)24h6101213H3511H212H3(H2627)b1612+
MFCD02957128
ZINC000002670477
ZINC02670477
ZINC2670477

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Available files

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