Vitas-M small molecule compound
methyl 2-{[(3-chlorophenoxy)acetyl]amino}-6-methyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STL172006
SMILES COC(=O)c1c(NC(=O)COc2cccc(c2)Cl)sc2c1CCC(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 C19H20ClNO4S MW 393.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H20ClNO4S/c1-11-6-7-14-15(8-11)26-18(17(14)19(23)24-2)21-16(22)10-25-13-5-3-4-12(20)9-13/h3-5,9,11H,6-8,10H2,1-2H3,(H,21,22)InChIKey
WWTXSNOBFLFOBT-UHFFFAOYSA-NSynonyms
445252-23-3445252233
CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)COC3=CC(=CC=C3)Cl
InChI=1SC19H20ClNO4Sc111671415(811)2618(17(14)19(23)242)2116(22)10251353412(20)913h35911H6810H212H3(H2122)
methyl2(((3chlorophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
methyl2((2(3chlorophenoxy)acetyl)amino)6methyl4567tetrahydro1benzothiophene3carboxylate
MFCD01650656
ZINC000000669753
ZINC000002746924
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