Vitas-M small molecule compound

methyl 4-({[4-(methylsulfonyl)piperazin-1-yl]carbonyl}amino)benzoate

Catalog ID
STL240336
SMILES COC(=O)c1ccc(cc1)NC(=O)N1CCN(CC1)S(=O)(=O)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 C14H19N3O5S MW 341.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H19N3O5S/c1-22-13(18)11-3-5-12(6-4-11)15-14(19)16-7-9-17(10-8-16)23(2,20)21/h3-6H,7-10H2,1-2H3,(H,15,19)
InChIKey
XCTWINJKICJJCP-UHFFFAOYSA-N
Synonyms
1081125-59-8
1081125598
COC(=O)C1=CC=C(C=C1)NC(=O)N2CCN(CC2)S(=O)(=O)C
InChI=1SC14H19N3O5Sc12213(18)113512(6411)1514(19)167917(10816)23(220)21h36H710H212H3(H1519)
methyl4(((4(methylsulfonyl)piperazin1yl)carbonyl)amino)benzoate
methyl4((4methylsulfonylpiperazine1carbonyl)amino)benzoate
methyl4(4(methylsulfonyl)piperazine1carboxamido)benzoate
MFCD12209712
ZINC000020744509
ZINC20744509

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Available files

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