Vitas-M small molecule compound

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

Catalog ID
STL133075
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)C(=O)N1CCN(CC1)c1ccccc1

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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 C28H36N6O3S MW 536.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H36N6O3S/c1-4-33-21-25(28(35)32-15-13-30(14-16-32)24-10-6-5-7-11-24)27(29-33)38(36,37)34-19-17-31(18-20-34)26-12-8-9-22(2)23(26)3/h5-12,21H,4,13-20H2,1-3H3
InChIKey
BQCXBQOVNREMTH-UHFFFAOYSA-N
Synonyms

(3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)(4phenylpiperazin1yl)methanone
(3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)(4phenylpiperazin1yl)methanone
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)N4CCN(CC4)C5=CC=CC=C5
InChI=1SC28H36N6O3Sc14332125(28(35)32151330(141632)24106571124)27(2933)38(3637)34191731(182034)26128922(2)23(26)3h51221H41320H213H3
MFCD20753018
ZINC000102921041
ZINC102921041

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Available files

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