Vitas-M small molecule compound
3-(3-{4-[(3,5-dimethyl-1H-pyrazol-4-yl)sulfonyl]piperazin-1-yl}-3-oxopropyl)-2-hydroxy-3,4-dihydro-5H-1,4-benzodiazepin-5-one
Catalog ID
STL421457
SMILES OC1=Nc2ccccc2C(=O)NC1CCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)[nH]nc1C
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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 C21H26N6O5S MW 474.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N6O5S/c1-13-19(14(2)25-24-13)33(31,32)27-11-9-26(10-12-27)18(28)8-7-17-21(30)22-16-6-4-3-5-15(16)20(29)23-17/h3-6,17H,7-12H2,1-2H3,(H,22,30)(H,23,29)(H,24,25)InChIKey
JKIWPXNNCHFYTQ-UHFFFAOYSA-NSynonyms
3(3(4((35dimethyl1Hpyrazol4yl)sulfonyl)piperazin1yl)3oxopropyl)2hydroxy34dihydro5H14benzodiazepin5one
CC1=C(C(=NN1)C)S(=O)(=O)N2CCN(CC2)C(=O)CCC3C(=O)NC4=CC=CC=C4C(=O)N3
InChI=1SC21H26N6O5Sc11319(14(2)252413)33(3132)2711926(101227)18(28)871721(30)2216643515(16)20(29)2317h3617H712H212H3(H2230)(H2329)(H2425)
MFCD30707536
OC1=Nc2ccccc2C(=O)NC1CCC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)(nH)nc1C
ZINC000218281249
ZINC000252536739
Check stock
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