Vitas-M small molecule compound
ethyl 6-ethyl-2-[(9H-xanthen-9-ylcarbonyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK418683
SMILES CCOC(=O)c1c(NC(=O)C2c3ccccc3Oc3c2cccc3)sc2c1CCC(C2)CC
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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 C27H27NO4S MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27NO4S/c1-3-16-13-14-19-22(15-16)33-26(24(19)27(30)31-4-2)28-25(29)23-17-9-5-7-11-20(17)32-21-12-8-6-10-18(21)23/h5-12,16,23H,3-4,13-15H2,1-2H3,(H,28,29)InChIKey
RXZMWPDLJTXZLV-UHFFFAOYSA-NSynonyms
354545-31-6354545316
CCC1CCC2=C(C1)SC(=C2C(=O)OCC)NC(=O)C3C4=CC=CC=C4OC5=CC=CC=C35
ethyl6ethyl2((9Hxanthen9ylcarbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl6ethyl2(9Hxanthene9carbonylamino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC27H27NO4Sc131613141922(1516)3326(24(19)27(30)3142)2825(29)23179571120(17)322112861018(21)23h5121623H341315H212H3(H2829)
MFCD01350337
ZINC000002738458
ZINC000002738459
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