Vitas-M small molecule compound
(2E)-3-[4-methoxy-3-(1H-pyrazol-1-ylmethyl)phenyl]-1-(5-methylthiophen-2-yl)prop-2-en-1-one
Catalog ID
STL399925
SMILES COc1ccc(cc1Cn1cccn1)/C=C/C(=O)c1ccc(s1)C
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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 C19H18N2O2S MW 338.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N2O2S/c1-14-4-9-19(24-14)17(22)7-5-15-6-8-18(23-2)16(12-15)13-21-11-3-10-20-21/h3-12H,13H2,1-2H3/b7-5+InChIKey
UVSCYCDCYSBWFS-FNORWQNLSA-NSynonyms
(2E)3(4METHOXY3(1HPYRAZOL1YLMETHYL)PHENYL)1(5METHYLTHIOPHEN2YL)PROP2EN1ONE
(E)3(4METHOXY3(PYRAZOL1YLMETHYL)PHENYL)1(5METHYLTHIOPHEN2YL)PROP2EN1ONE
CC1=CC=C(S1)C(=O)C=CC2=CC(=C(C=C2)OC)CN3C=CC=N3
COc1ccc(cc1Cn1cccn1)C=CC(=O)c1ccc(s1)C
InChI=1SC19H18N2O2Sc1144919(2414)17(22)75156818(232)16(1215)1321113102021h312H13H212H3b75+
MFCD28952584
ZINC000008551019
ZINC8551019
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