Vitas-M small molecule compound

methyl 5-benzyl-2-{[(4-chlorophenoxy)acetyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK020625
SMILES COC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)Cc1ccccc1

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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 C22H20ClNO4S MW 429.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20ClNO4S/c1-14-18(12-15-6-4-3-5-7-15)29-21(20(14)22(26)27-2)24-19(25)13-28-17-10-8-16(23)9-11-17/h3-11H,12-13H2,1-2H3,(H,24,25)
InChIKey
NOPFSWNKWGAFPP-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=O)COC2=CC=C(C=C2)Cl)CC3=CC=CC=C3
COC(=O)c1c(NC(=O)COc2ccc(cc2)Cl)sc(c1C)Cc1ccccc1
InChI=1SC22H20ClNO4Sc11418(12156435715)2921(20(14)22(26)272)2419(25)13281710816(23)91117h311H1213H212H3(H2425)
METHYL2(2(4CHLOROPHENOXY)ACETYLAMINO)4METHYL5BENZYLTHIOPHENE3CARBOXYLATE
METHYL5BENZYL2(((4CHLOROPHENOXY)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5BENZYL2((2(4CHLOROPHENOXY)ACETYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5BENZYL2(2(4CHLOROPHENOXY)ACETAMIDO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD02006271
STK020625
ZINC000008861526
ZINC08861526
ZINC8861526

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.