Vitas-M small molecule compound
ethyl 2-{[(2-benzyl-5-oxopyrazolidin-3-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK988743
SMILES CCOC(=O)c1c(NC(=O)C2CC(=O)NN2Cc2ccccc2)sc2c1CCCC2
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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 C22H25N3O4S MW 427.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25N3O4S/c1-2-29-22(28)19-15-10-6-7-11-17(15)30-21(19)23-20(27)16-12-18(26)24-25(16)13-14-8-4-3-5-9-14/h3-5,8-9,16H,2,6-7,10-13H2,1H3,(H,23,27)(H,24,26)InChIKey
XQVUMBLBXGCAQB-UHFFFAOYSA-NSynonyms
956741-53-0956741530
CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3CC(=O)NN3CC4=CC=CC=C4
ethyl2(((2benzyl5oxopyrazolidin3yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
ethyl2((2benzyl5oxopyrazolidine3carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
InChI=1SC22H25N3O4Sc122922(28)191510671117(15)3021(19)2320(27)161218(26)2425(16)13148435914h358916H2671013H21H3(H2327)(H2426)
MFCD05718499
ZINC000001113668
ZINC000001113670
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