Vitas-M small molecule compound
ethyl 2-{[(4-butylphenyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK438985
SMILES CCCCc1ccc(cc1)NC(=S)Nc1sc2c(c1C(=O)OCC)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 C24H32N2O2S2 MW 444.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O2S2/c1-3-5-10-17-13-15-18(16-14-17)25-24(29)26-22-21(23(27)28-4-2)19-11-8-6-7-9-12-20(19)30-22/h13-16H,3-12H2,1-2H3,(H2,25,26,29)InChIKey
DHRYYYWZQISZBM-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)NC(=S)NC2=C(C3=C(S2)CCCCCC3)C(=O)OCC
ethyl2(((4butylphenyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((4butylphenyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC24H32N2O2S2c1351017131518(161417)2524(29)262221(23(27)2842)191186791220(19)3022h1316H312H212H3(H2252629)
MFCD03945850
ZINC000005946374
ZINC05946374
ZINC5946374
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