Vitas-M small molecule compound

(2Z)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(thiophen-2-ylmethyl)prop-2-enamide

Catalog ID
STK474424
SMILES CCCCOc1ccc(cc1/C=C(\C(=O)NCc1cccs1)/C#N)Br

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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 C19H19BrN2O2S MW 419.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19BrN2O2S/c1-2-3-8-24-18-7-6-16(20)11-14(18)10-15(12-21)19(23)22-13-17-5-4-9-25-17/h4-7,9-11H,2-3,8,13H2,1H3,(H,22,23)/b15-10-
InChIKey
SBCMGKDYBBEQHP-GDNBJRDFSA-N
Synonyms

(2Z)3(5BROMO2BUTOXYPHENYL)2CYANON(2THIENYLMETHYL)PROP2ENAMIDE
(2Z)3(5bromo2butoxyphenyl)2cyanoN(thiophen2ylmethyl)prop2enamide
(Z)3(5bromo2butoxyphenyl)2cyanoN(thiophen2ylmethyl)prop2enamide
CCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NCC2=CC=CS2
CCCCOc1ccc(cc1C=C(C(=O)NCc1cccs1)C#N)Br
InChI=1SC19H19BrN2O2Sc123824187616(20)1114(18)1015(1221)19(23)2213175492517h47911H23813H21H3(H2223)b1510
MFCD07081126
ZINC000017091778
ZINC17091778

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Available files

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