Vitas-M small molecule compound
methyl 2-({[4,5-dimethoxy-2-(methoxycarbonyl)phenyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK460202
SMILES COC(=O)c1cc(OC)c(cc1NC(=S)Nc1sc2c(c1C(=O)OC)CCCCCC2)OC
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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 C23H28N2O6S2 MW 492.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O6S2/c1-28-16-11-14(21(26)30-3)15(12-17(16)29-2)24-23(32)25-20-19(22(27)31-4)13-9-7-5-6-8-10-18(13)33-20/h11-12H,5-10H2,1-4H3,(H2,24,25,32)InChIKey
KVYYEQWIYXHMSA-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C(=C1)C(=O)OC)NC(=S)NC2=C(C3=C(S2)CCCCCC3)C(=O)OC)OC
InChI=1SC23H28N2O6S2c128161114(21(26)303)15(1217(16)292)2423(32)252019(22(27)314)13975681018(13)3320h1112H510H214H3(H2242532)
methyl2(((45dimethoxy2(methoxycarbonyl)phenyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2((45dimethoxy2methoxycarbonylphenyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD05069049
ZINC000002858767
ZINC02858767
ZINC2858767
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