Vitas-M small molecule compound
ethyl 2-{[(2,4-dimethoxyphenyl)carbamothioyl]amino}-4,5,6,7,8,9-hexahydrocycloocta[b]thiophene-3-carboxylate
Catalog ID
STK438969
SMILES CCOC(=O)c1c(NC(=S)Nc2ccc(cc2OC)OC)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 C22H28N2O4S2 MW 448.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N2O4S2/c1-4-28-21(25)19-15-9-7-5-6-8-10-18(15)30-20(19)24-22(29)23-16-12-11-14(26-2)13-17(16)27-3/h11-13H,4-10H2,1-3H3,(H2,23,24,29)InChIKey
ICUDUZUOVMFVLD-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCCCC2)NC(=S)NC3=C(C=C(C=C3)OC)OC
ethyl2(((24dimethoxyphenyl)carbamothioyl)amino)456789hexahydrocycloocta(b)thiophene3carboxylate
ethyl2((24dimethoxyphenyl)carbamothioylamino)456789hexahydrocycloocta(b)thiophene3carboxylate
InChI=1SC22H28N2O4S2c142821(25)1915975681018(15)3020(19)2422(29)2316121114(262)1317(16)273h1113H410H213H3(H2232429)
MFCD03945833
ZINC000005948046
ZINC05948046
ZINC5948046
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