Vitas-M small molecule compound
(2E)-1-(1-methyl-1H-pyrazol-4-yl)-3-(3-methylthiophen-2-yl)prop-2-en-1-one
Catalog ID
STL393364
SMILES Cn1ncc(c1)C(=O)/C=C/c1sccc1C
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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/c1-9-5-6-16-12(9)4-3-11(15)10-7-13-14(2)8-10/h3-8H,1-2H3/b4-3+InChIKey
CPTBBOQFRUUSPF-ONEGZZNKSA-NSynonyms
1005570-45-5(2E)1(1METHYL1HPYRAZOL4YL)3(3METHYLTHIOPHEN2YL)PROP2EN1ONE
(E)1(1methylpyrazol4yl)3(3methylthiophen2yl)prop2en1one
1005570455
CC1=C(SC=C1)C=CC(=O)C2=CN(N=C2)C
Cn1ncc(c1)C(=O)C=Cc1sccc1C
InChI=1SC12H12N2OSc19561612(9)4311(15)1071314(2)810h38H12H3b43+
MFCD04054192
ZINC000006790053
ZINC06790053
ZINC6790053
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