Vitas-M small molecule compound
propan-2-yl 2-{[(2-ethoxyphenyl)carbonyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK429155
SMILES CCOc1ccccc1C(=O)Nc1sc2c(c1C(=O)OC(C)C)CCC(C2)C
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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 C22H27NO4S MW 401.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27NO4S/c1-5-26-17-9-7-6-8-15(17)20(24)23-21-19(22(25)27-13(2)3)16-11-10-14(4)12-18(16)28-21/h6-9,13-14H,5,10-12H2,1-4H3,(H,23,24)InChIKey
XOABCYHZSJWXIX-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C(=O)NC2=C(C3=C(S2)CC(CC3)C)C(=O)OC(C)C
InChI=1SC22H27NO4Sc152617976815(17)20(24)232119(22(25)2713(2)3)16111014(4)1218(16)2821h691314H51012H214H3(H2324)
MFCD01327803
propan2yl2(((2ethoxyphenyl)carbonyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2ethoxybenzoyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
ZINC000002780017
ZINC000002780018
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