Vitas-M small molecule compound
methyl 2-({[2-(3,4-dimethoxyphenyl)ethyl]carbamothioyl}amino)-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK457545
SMILES COc1ccc(cc1OC)CCNC(=S)Nc1sc2c(c1C(=O)OC)CCCCCC2
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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 C23H30N2O4S2 MW 462.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N2O4S2/c1-27-17-11-10-15(14-18(17)28-2)12-13-24-23(30)25-21-20(22(26)29-3)16-8-6-4-5-7-9-19(16)31-21/h10-11,14H,4-9,12-13H2,1-3H3,(H2,24,25,30)InChIKey
OQATWSXBGOWMOO-UHFFFAOYSA-NSynonyms
COC1=C(C=C(C=C1)CCNC(=S)NC2=C(C3=C(S2)CCCCCC3)C(=O)OC)OC
InChI=1SC23H30N2O4S2c12717111015(1418(17)282)12132423(30)252120(22(26)293)1686457919(16)3121h101114H491213H213H3(H2242530)
methyl2(((2(34dimethoxyphenyl)ethyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
methyl2(2(34dimethoxyphenyl)ethylcarbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
MFCD05114898
ZINC000002856200
ZINC02856200
ZINC2856200
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