Vitas-M small molecule compound

(2Z)-3-{1-[4-(acetylamino)phenyl]-2,5-dimethyl-1H-pyrrol-3-yl}-2-cyano-N-(4-ethoxyphenyl)prop-2-enamide

Catalog ID
STK378043
SMILES CCOc1ccc(cc1)NC(=O)/C(=C\c1cc(n(c1C)c1ccc(cc1)NC(=O)C)C)/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 C26H26N4O3 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N4O3/c1-5-33-25-12-8-23(9-13-25)29-26(32)21(16-27)15-20-14-17(2)30(18(20)3)24-10-6-22(7-11-24)28-19(4)31/h6-15H,5H2,1-4H3,(H,28,31)(H,29,32)/b21-15-
InChIKey
MPPVBQQNCDWNPU-QNGOZBTKSA-N
Synonyms

(2Z)3(1(4(acetylamino)phenyl)25dimethyl1Hpyrrol3yl)2cyanoN(4ethoxyphenyl)prop2enamide
(2Z)3(1(4(ACETYLAMINO)PHENYL)25DIMETHYLPYRROL3YL)2CYANON(4ETHOXYPHENYL)PROP2ENAMIDE
(Z)3(1(4acetamidophenyl)25dimethylpyrrol3yl)2cyanoN(4ethoxyphenyl)prop2enamide
CCOC1=CC=C(C=C1)NC(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)NC(=O)C)C)C#N
CCOc1ccc(cc1)NC(=O)C(=Cc1cc(n(c1C)c1ccc(cc1)NC(=O)C)C)C#N
InChI=1SC26H26N4O3c15332512823(91325)2926(32)21(1627)15201417(2)30(18(20)3)2410622(71124)2819(4)31h615H5H214H3(H2831)(H2932)b2115
MFCD02067121
ZINC000016157369
ZINC16157369

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Available files

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