Vitas-M small molecule compound
(2E)-1-(1-methyl-1H-pyrazol-4-yl)-3-(5-methylthiophen-2-yl)prop-2-en-1-one
Catalog ID
STL391586
SMILES Cn1ncc(c1)C(=O)/C=C/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 C12H12N2OS MW 232.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2OS/c1-9-3-4-11(16-9)5-6-12(15)10-7-13-14(2)8-10/h3-8H,1-2H3/b6-5+InChIKey
SWXOJNCJYOTXKX-AATRIKPKSA-NSynonyms
1005629-02-6(2E)1(1methyl1Hpyrazol4yl)3(5methylthiophen2yl)prop2en1one
(2E)3(5METHYL(2THIENYL))1(1METHYLPYRAZOL4YL)PROP2EN1ONE
(E)1(1methylpyrazol4yl)3(5methylthiophen2yl)prop2en1one
1005629026
CC1=CC=C(S1)C=CC(=O)C2=CN(N=C2)C
Cn1ncc(c1)C(=O)C=Cc1ccc(s1)C
InChI=1SC12H12N2OSc193411(169)5612(15)1071314(2)810h38H12H3b65+
MFCD04054195
ZINC000006788903
ZINC06788903
ZINC6788903
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