Vitas-M small molecule compound
N-[(4-ethyl-5-{[2-(4-fluorophenyl)-2-oxoethyl]sulfanyl}-4H-1,2,4-triazol-3-yl)methyl]-3-methylbenzamide
Catalog ID
STK497569
SMILES CCn1c(SCC(=O)c2ccc(cc2)F)nnc1CNC(=O)c1cccc(c1)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 C21H21FN4O2S MW 412.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21FN4O2S/c1-3-26-19(12-23-20(28)16-6-4-5-14(2)11-16)24-25-21(26)29-13-18(27)15-7-9-17(22)10-8-15/h4-11H,3,12-13H2,1-2H3,(H,23,28)InChIKey
LXHSKYDHWPMSNY-UHFFFAOYSA-NSynonyms
CCN1C(=NN=C1SCC(=O)C2=CC=C(C=C2)F)CNC(=O)C3=CC(=CC=C3)C
InChI=1SC21H21FN4O2Sc132619(122320(28)1664514(2)1116)242521(26)291318(27)157917(22)10815h411H31213H212H3(H2328)
MFCD11854957
N((4ethyl5((2(4fluorophenyl)2oxoethyl)sulfanyl)4H124triazol3yl)methyl)3methylbenzamide
N((4ethyl5(2(4fluorophenyl)2oxoethyl)sulfanyl124triazol3yl)methyl)3methylbenzamide
ZINC000032579316
ZINC32579316
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