Vitas-M small molecule compound

methyl 2-{[(4-benzylpiperazin-1-yl)acetyl]amino}-5-methylthiophene-3-carboxylate

Catalog ID
STK476620
SMILES COC(=O)c1cc(sc1NC(=O)CN1CCN(CC1)Cc1ccccc1)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 C20H25N3O3S MW 387.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O3S/c1-15-12-17(20(25)26-2)19(27-15)21-18(24)14-23-10-8-22(9-11-23)13-16-6-4-3-5-7-16/h3-7,12H,8-11,13-14H2,1-2H3,(H,21,24)
InChIKey
VMOBLGYYEKQLTO-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(S1)NC(=O)CN2CCN(CC2)CC3=CC=CC=C3)C(=O)OC
InChI=1SC20H25N3O3Sc1151217(20(25)262)19(2715)2118(24)142310822(91123)13166435716h3712H8111314H212H3(H2124)
methyl2(((4benzylpiperazin1yl)acetyl)amino)5methylthiophene3carboxylate
METHYL2((2(4BENZYLPIPERAZIN1YL)ACETYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
METHYL5METHYL2(2(4BENZYLPIPERAZINYL)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD06050409
ZINC000020344854
ZINC20344854

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Available files

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