Vitas-M small molecule compound
ethyl 2-{[(4,4-dioxido-3-phenyl-5,6-dihydro-1,4-oxathiin-2-yl)carbonyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate
Catalog ID
STK660890
SMILES CCOC(=O)c1c(NC(=O)C2=C(c3ccccc3)S(=O)(=O)CCO2)sc2c1CCC2
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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 C21H21NO6S2 MW 447.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6S2/c1-2-27-21(24)16-14-9-6-10-15(14)29-20(16)22-19(23)17-18(13-7-4-3-5-8-13)30(25,26)12-11-28-17/h3-5,7-8H,2,6,9-12H2,1H3,(H,22,23)InChIKey
NHMVFTIIGIVUOM-UHFFFAOYSA-NSynonyms
1144479-87-71144479877
CCOC(=O)C1=C(SC2=C1CCC2)NC(=O)C3=C(S(=O)(=O)CCO3)C4=CC=CC=C4
ethyl2(((44dioxido3phenyl56dihydro14oxathiin2yl)carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ETHYL2((44DIOXO5PHENYL23DIHYDRO14OXATHIIN6YL)CARBONYLAMINO)456TRIHYDROCYCLOPENTA(21B)THIOPHENE3CARBOXYLATE
ethyl2((44dioxo5phenyl23dihydro14oxathiine6carbonyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
ethyl2(44dioxido3phenyl56dihydro14oxathiine2carboxamido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
InChI=1SC21H21NO6S2c122721(24)1614961015(14)2920(16)2219(23)1718(137435813)30(2526)12112817h3578H26912H21H3(H2223)
MFCD12213806
ZINC000032091962
ZINC32091962
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