Vitas-M small molecule compound
3-[5-({[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]-1-(methylsulfonyl)piperidine
Catalog ID
STK473434
SMILES C=CCn1c(SCc2csc(n2)c2ccc(cc2)C)nnc1C1CCCN(C1)S(=O)(=O)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 C22H27N5O2S3 MW 489.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S3/c1-4-11-27-20(18-6-5-12-26(13-18)32(3,28)29)24-25-22(27)31-15-19-14-30-21(23-19)17-9-7-16(2)8-10-17/h4,7-10,14,18H,1,5-6,11-13,15H2,2-3H3InChIKey
IPINGCFXHHZTLV-UHFFFAOYSA-NSynonyms
2(4methylphenyl)4((5(1methylsulfonylpiperidin3yl)4prop2enyl124triazol3yl)sulfanylmethyl)13thiazole
3(5(((2(4methylphenyl)13thiazol4yl)methyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)1(methylsulfonyl)piperidine
3(5((2(4METHYLPHENYL)(13THIAZOL4YL))METHYLTHIO)4PROP2ENYL(124TRIAZOL3YL))1(METHYLSULFONYL)PIPERIDINE
CC1=CC=C(C=C1)C2=NC(=CS2)CSC3=NN=C(N3CC=C)C4CCCN(C4)S(=O)(=O)C
InChI=1SC22H27N5O2S3c14112720(18651226(1318)32(328)29)242522(27)311519143021(2319)179716(2)81017h47101418H156111315H223H3
MFCD07612576
ZINC000020394186
ZINC000020394189
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