Vitas-M small molecule compound

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

Catalog ID
STL133087
SMILES CCn1cc(c(n1)S(=O)(=O)N1CCN(CC1)c1cccc(c1C)C)C(=O)N1CC1C

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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 C21H29N5O3S MW 431.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5O3S/c1-5-24-14-18(21(27)26-13-16(26)3)20(22-24)30(28,29)25-11-9-23(10-12-25)19-8-6-7-15(2)17(19)4/h6-8,14,16H,5,9-13H2,1-4H3
InChIKey
DDTCCEKPJCASEV-UHFFFAOYSA-N
Synonyms

(3((4(23dimethylphenyl)piperazin1yl)sulfonyl)1ethyl1Hpyrazol4yl)(2methylaziridin1yl)methanone
(3(4(23dimethylphenyl)piperazin1yl)sulfonyl1ethylpyrazol4yl)(2methylaziridin1yl)methanone
CCN1C=C(C(=N1)S(=O)(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)C(=O)N4CC4C
InChI=1SC21H29N5O3Sc15241418(21(27)261316(26)3)20(2224)30(2829)2511923(101225)1986715(2)17(19)4h681416H5913H214H3
MFCD20753030
ZINC000067338427
ZINC000067338431

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Available files

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