Vitas-M small molecule compound
(2Z)-2-cyano-N-(3-methoxyphenyl)-3-{1-[3-(trifluoromethyl)phenyl]-1H-pyrrol-2-yl}prop-2-enamide
Catalog ID
STK178784
SMILES COc1cccc(c1)NC(=O)/C(=C\c1cccn1c1cccc(c1)C(F)(F)F)/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 C22H16F3N3O2 MW 411.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16F3N3O2/c1-30-20-9-3-6-17(13-20)27-21(29)15(14-26)11-18-8-4-10-28(18)19-7-2-5-16(12-19)22(23,24)25/h2-13H,1H3,(H,27,29)/b15-11-InChIKey
SZMSDYYHCBWWLV-PTNGSMBKSA-NSynonyms
(2Z)2CYANON(3METHOXYPHENYL)3(1(3(TRIFLUOROMETHYL)PHENYL)1HPYRROL2YL)PROP2ENAMIDE
(Z)2cyanoN(3methoxyphenyl)3(1(3(trifluoromethyl)phenyl)pyrrol2yl)prop2enamide
COC1=CC=CC(=C1)NC(=O)C(=CC2=CC=CN2C3=CC=CC(=C3)C(F)(F)F)C#N
COc1cccc(c1)NC(=O)C(=Cc1cccn1c1cccc(c1)C(F)(F)F)C#N
InChI=1SC22H16F3N3O2c1302093617(1320)2721(29)15(1426)1118841028(18)1972516(1219)22(2324)25h213H1H3(H2729)b1511
MFCD03649550
ZINC000004704899
ZINC4704899
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