Vitas-M small molecule compound

methyl 4-(4-fluorophenyl)-2-[({4-[(4-methoxyphenyl)sulfonyl]piperazin-1-yl}acetyl)amino]thiophene-3-carboxylate

Catalog ID
STK467500
SMILES COC(=O)c1c(scc1c1ccc(cc1)F)NC(=O)CN1CCN(CC1)S(=O)(=O)c1ccc(cc1)OC

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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 C25H26FN3O6S2 MW 547.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H26FN3O6S2/c1-34-19-7-9-20(10-8-19)37(32,33)29-13-11-28(12-14-29)15-22(30)27-24-23(25(31)35-2)21(16-36-24)17-3-5-18(26)6-4-17/h3-10,16H,11-15H2,1-2H3,(H,27,30)
InChIKey
SBRXECNSCUNCPQ-UHFFFAOYSA-N
Synonyms

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)OC
InChI=1SC25H26FN3O6S2c134197920(10819)37(3233)29131128(121429)1522(30)272423(25(31)352)21(163624)173518(26)6417h31016H1115H212H3(H2730)
methyl4(4fluorophenyl)2(((4((4methoxyphenyl)sulfonyl)piperazin1yl)acetyl)amino)thiophene3carboxylate
methyl4(4fluorophenyl)2((2(4(4methoxyphenyl)sulfonylpiperazin1yl)acetyl)amino)thiophene3carboxylate
METHYL4(4FLUOROPHENYL)2(2(4((4METHOXYPHENYL)SULFONYL)PIPERAZINYL)ACETYLAMINO)THIOPHENE3CARBOXYLATE
MFCD05123164
ZINC000097947971
ZINC97947971

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Available files

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