Vitas-M small molecule compound
methyl 2-{[(4-propylphenoxy)acetyl]amino}-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STL481794
SMILES CCCc1ccc(cc1)OCC(=O)Nc1sc2c(c1C(=O)OC)CCCCC2
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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/c1-3-7-15-10-12-16(13-11-15)27-14-19(24)23-21-20(22(25)26-2)17-8-5-4-6-9-18(17)28-21/h10-13H,3-9,14H2,1-2H3,(H,23,24)InChIKey
BCDITPKABGOGEN-UHFFFAOYSA-NSynonyms
332874-17-6332874176
CCCC1=CC=C(C=C1)OCC(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)OC
InChI=1SC22H27NO4Sc13715101216(131115)271419(24)232120(22(25)262)178546918(17)2821h1013H3914H212H3(H2324)
methyl2(((4propylphenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((2(4propylphenoxy)acetyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD01920049
ZINC000002084858
ZINC02084858
ZINC2084858
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