Vitas-M small molecule compound
ethyl 2-{[(4-methylpiperazin-1-yl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK462387
SMILES CCOC(=O)c1c(NC(=S)NN2CCN(CC2)C)sc2c1CCCCCC2
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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 C19H30N4O2S2 MW 410.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H30N4O2S2/c1-3-25-18(24)16-14-8-6-4-5-7-9-15(14)27-17(16)20-19(26)21-23-12-10-22(2)11-13-23/h3-13H2,1-2H3,(H2,20,21,26)InChIKey
RORGNUOZLHGTAE-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NN3CCN(CC3)C
ethyl2(((4methylpiperazin1yl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((4methylpiperazin1yl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC19H30N4O2S2c132518(24)161486457915(14)2717(16)2019(26)2123121022(2)111323h313H212H3(H2202126)
MFCD04137578
ZINC000002858189
ZINC2858189
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