Vitas-M small molecule compound
ethyl 2-({[(3-fluorophenyl)carbonyl]carbamothioyl}amino)-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK073522
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2cccc(c2)F)sc2c1CCC(C2)C(CC)(C)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 C24H29FN2O3S2 MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29FN2O3S2/c1-5-24(3,4)15-10-11-17-18(13-15)32-21(19(17)22(29)30-6-2)27-23(31)26-20(28)14-8-7-9-16(25)12-14/h7-9,12,15H,5-6,10-11,13H2,1-4H3,(H2,26,27,28,31)InChIKey
LTYDTMPGXWBMLG-UHFFFAOYSA-NSynonyms
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=S)NC(=O)C3=CC(=CC=C3)F
CCOC(=O)c1c(NC(=S)NC(=O)c2cccc(c2)F)sc2c1CCC(C2)C(CC)(C)C
ethyl2((((3fluorophenyl)carbonyl)carbamothioyl)amino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
ethyl2((3fluorobenzoyl)carbamothioylamino)6(2methylbutan2yl)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC24H29FN2O3S2c1524(34)1510111718(1315)3221(19(17)22(29)3062)2723(31)2620(28)1487916(25)1214h791215H56101113H214H3(H226272831)
MFCD03065835
STK073522
ZINC000009659491
ZINC000013899015
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