Vitas-M small molecule compound

2-({6-[(2-chlorobenzyl)amino]pyrimidin-4-yl}sulfanyl)-1-[4-(4-fluorophenyl)piperazin-1-yl]ethanone

Catalog ID
STL079893
SMILES Fc1ccc(cc1)N1CCN(CC1)C(=O)CSc1ncnc(c1)NCc1ccccc1Cl

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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 C23H23ClFN5OS MW 471.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23ClFN5OS/c24-20-4-2-1-3-17(20)14-26-21-13-22(28-16-27-21)32-15-23(31)30-11-9-29(10-12-30)19-7-5-18(25)6-8-19/h1-8,13,16H,9-12,14-15H2,(H,26,27,28)
InChIKey
JLAMTSZRXBWTAC-UHFFFAOYSA-N
Synonyms

2((6((2chlorobenzyl)amino)pyrimidin4yl)sulfanyl)1(4(4fluorophenyl)piperazin1yl)ethanone
2(6((2chlorophenyl)methylamino)pyrimidin4yl)sulfanyl1(4(4fluorophenyl)piperazin1yl)ethanone
C1CN(CCN1C2=CC=C(C=C2)F)C(=O)CSC3=NC=NC(=C3)NCC4=CC=CC=C4Cl
InChI=1SC23H23ClFN5OSc2420421317(20)1426211322(28162721)321523(31)3011929(101230)197518(25)6819h181316H9121415H2(H262728)
MFCD15141169
ZINC000033174831
ZINC33174831

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Available files

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