Vitas-M small molecule compound
(2Z)-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-1-benzofuran-6-yl cyclohexanecarboxylate
Catalog ID
STK856839
SMILES O=C(C1CCCCC1)Oc1ccc2c(c1)O/C(=C\c1cccs1)/C2=O
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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 C20H18O4S MW 354.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18O4S/c21-19-16-9-8-14(23-20(22)13-5-2-1-3-6-13)11-17(16)24-18(19)12-15-7-4-10-25-15/h4,7-13H,1-3,5-6H2/b18-12-InChIKey
YABWSBWACJQWAP-PDGQHHTCSA-NSynonyms
623115-91-3((2Z)3oxo2(thiophen2ylmethylidene)1benzofuran6yl)cyclohexanecarboxylate
(2Z)3oxo2(thiophen2ylmethylidene)23dihydro1benzofuran6ylcyclohexanecarboxylate
(Z)3oxo2(thiophen2ylmethylene)23dihydrobenzofuran6ylcyclohexanecarboxylate
3OXO2(2THIENYLMETHYLENE)BENZO(34B)FURAN6YLCYCLOHEXANECARBOXYLATE
623115913
C1CCC(CC1)C(=O)OC2=CC3=C(C=C2)C(=O)C(=CC4=CC=CS4)O3
InChI=1SC20H18O4Sc2119169814(2320(22)135213613)1117(16)2418(19)121574102515h4713H1356H2b1812
MFCD06295249
O=C(C1CCCCC1)Oc1ccc2c(c1)OC(=Cc1cccs1)C2=O
ZINC000009419055
ZINC09419055
ZINC9419055
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