Vitas-M small molecule compound
ethyl 2-({(E)-2-cyano-2-[4-(naphthalen-2-yl)-1,3-thiazol-2-yl]ethenyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK553383
SMILES CCOC(=O)c1c(N/C=C(/c2scc(n2)c2ccc3c(c2)cccc3)\C#N)sc2c1CCCC2
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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 C27H23N3O2S2 MW 485.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O2S2/c1-2-32-27(31)24-21-9-5-6-10-23(21)34-26(24)29-15-20(14-28)25-30-22(16-33-25)19-12-11-17-7-3-4-8-18(17)13-19/h3-4,7-8,11-13,15-16,29H,2,5-6,9-10H2,1H3/b20-15+InChIKey
BSUIELPIGALVOF-HMMYKYKNSA-NSynonyms
799769-67-8(E)ethyl2((2cyano2(4(naphthalen2yl)thiazol2yl)vinyl)amino)4567tetrahydrobenzo(b)thiophene3carboxylate
799769678
CCOC(=O)C1=C(SC2=C1CCCC2)NC=C(C#N)C3=NC(=CS3)C4=CC5=CC=CC=C5C=C4
CCOC(=O)c1c(NC=C(c2scc(n2)c2ccc3c(c2)cccc3)C#N)sc2c1CCCC2
ethyl2(((E)2cyano2(4(naphthalen2yl)13thiazol2yl)ethenyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2(((E)2cyano2(4naphthalen2yl13thiazol2yl)ethenyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC27H23N3O2S2c123227(31)24219561023(21)3426(24)291520(1428)253022(163325)19121117734818(17)1319h34781113151629H256910H21H3b2015+
MFCD03671206
ZINC000013658784
ZINC13658784
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