Vitas-M small molecule compound

(3-{[4-(3-chlorophenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)(3,4-dihydroisoquinolin-2(1H)-yl)methanone

Catalog ID
STL132764
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cccc(c1)Cl)C(=O)N1CCc2c(C1)cccc2

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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 C25H28ClN5O3S MW 514.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28ClN5O3S/c1-2-30-18-23(25(32)29-11-10-19-6-3-4-7-20(19)17-29)24(27-30)35(33,34)31-14-12-28(13-15-31)22-9-5-8-21(26)16-22/h3-9,16,18H,2,10-15,17H2,1H3
InChIKey
UFUUFLWYTRHFCE-UHFFFAOYSA-N
Synonyms

(3((4(3chlorophenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)(34dihydroisoquinolin2(1H)yl)methanone
(3(4(3chlorophenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)(34dihydro1Hisoquinolin2yl)methanone
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)C(=O)N4CCC5=CC=CC=C5C4
InChI=1SC25H28ClN5O3Sc12301823(25(32)29111019634720(19)1729)24(2730)35(3334)31141228(131531)2295821(26)1622h391618H2101517H21H3
MFCD20752706
ZINC000067337536
ZINC67337536

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Available files

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