Vitas-M small molecule compound

(3-{[4-(2,5-dimethylphenyl)piperazin-1-yl]sulfonyl}-1-ethyl-1H-pyrazol-4-yl)(3,5-dimethyl-1H-pyrazol-1-yl)methanone

Catalog ID
STL073047
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cc(C)ccc1C)C(=O)n1nc(cc1C)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 C23H30N6O3S MW 470.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N6O3S/c1-6-27-15-20(23(30)29-19(5)14-18(4)24-29)22(25-27)33(31,32)28-11-9-26(10-12-28)21-13-16(2)7-8-17(21)3/h7-8,13-15H,6,9-12H2,1-5H3
InChIKey
JNPKRLPAVKQXIJ-UHFFFAOYSA-N
Synonyms

(3((4(25dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)(35dimethyl1Hpyrazol1yl)methanone
(3(4(25dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)(35dimethylpyrazol1yl)methanone
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=C(C=CC(=C3)C)C)C(=O)N4C(=CC(=N4)C)C
InChI=1SC23H30N6O3Sc16271520(23(30)2919(5)1418(4)2429)22(2527)33(3132)2811926(101228)211316(2)7817(21)3h781315H6912H215H3
MFCD18194682
ZINC000057478124
ZINC57478124

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Available files

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