Vitas-M small molecule compound

2-[4-({2-methyl-5-[3-(propan-2-yl)[1,2,4]triazolo[3,4-a]phthalazin-6-yl]phenyl}sulfonyl)piperazin-1-yl]ethanol

Catalog ID
STK796528
SMILES OCCN1CCN(CC1)S(=O)(=O)c1cc(ccc1C)c1nn2c(nnc2c2c1cccc2)C(C)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 C25H30N6O3S MW 494.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N6O3S/c1-17(2)24-26-27-25-21-7-5-4-6-20(21)23(28-31(24)25)19-9-8-18(3)22(16-19)35(33,34)30-12-10-29(11-13-30)14-15-32/h4-9,16-17,32H,10-15H2,1-3H3
InChIKey
DCYSNXJFPJEVHZ-UHFFFAOYSA-N
Synonyms
900876-98-4
2(4((2methyl5(3(propan2yl)(124)triazolo(34a)phthalazin6yl)phenyl)sulfonyl)piperazin1yl)ethanol
2(4((5(3isopropyl(124)triazolo(34a)phthalazin6yl)2methylphenyl)sulfonyl)piperazin1yl)ethanol
2(4(2METHYL5(3PROPAN2YL(124)TRIAZOLO(34A)PHTHALAZIN6YL)PHENYL)SULFONYLPIPERAZIN1YL)ETHANOL
900876984
CC1=C(C=C(C=C1)C2=NN3C(=NN=C3C(C)C)C4=CC=CC=C42)S(=O)(=O)N5CCN(CC5)CCO
InChI=1SC25H30N6O3Sc117(2)2426272521754620(21)23(2831(24)25)199818(3)22(1619)35(3334)30121029(111330)141532h49161732H1015H213H3
MFCD06778182
ZINC000020547075
ZINC20547075

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Available files

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