Vitas-M small molecule compound

N-(1,3-benzodioxol-5-yl)-4-[4-methyl-3-(piperidin-1-ylsulfonyl)phenyl]phthalazin-1-amine

Catalog ID
STK070114
SMILES Cc1ccc(cc1S(=O)(=O)N1CCCCC1)c1nnc(c2c1cccc2)Nc1ccc2c(c1)OCO2

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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 C27H26N4O4S MW 502.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N4O4S/c1-18-9-10-19(15-25(18)36(32,33)31-13-5-2-6-14-31)26-21-7-3-4-8-22(21)27(30-29-26)28-20-11-12-23-24(16-20)35-17-34-23/h3-4,7-12,15-16H,2,5-6,13-14,17H2,1H3,(H,28,30)
InChIKey
SANQLRYEMDMKHX-UHFFFAOYSA-N
Synonyms
442649-01-6
CC1=C(C=C(C=C1)C2=NN=C(C3=CC=CC=C32)NC4=CC5=C(C=C4)OCO5)S(=O)(=O)N6CCCCC6
Cc1ccc(cc1S(=O)(=O)N1CCCCC1)c1nnc(c2c1cccc2)Nc1ccc2c(c1)OCO2
InChI=1SC27H26N4O4Sc11891019(1525(18)36(3233)31135261431)2621734822(21)27(302926)282011122324(1620)35173423h347121516H256131417H21H3(H2830)
MFCD03298567
N((1Z)4(4METHYL3(PIPERIDIN1YLSULFONYL)PHENYL)PHTHALAZIN1(2H)YLIDENE)13BENZODIOXOL5AMINE
N(13BENZODIOXOL5YL)4(4METHYL3(PIPERIDIN1YLSULFONYL)PHENYL)PHTHALAZIN1AMINE
N(13BENZODIOXOL5YL)4(4METHYL3PIPERIDIN1YLSULFONYLPHENYL)PHTHALAZIN1AMINE
N(benzo(d)(13)dioxol5yl)4(4methyl3(piperidin1ylsulfonyl)phenyl)phthalazin1amine
STK070114
ZINC000009379839
ZINC09379839
ZINC9379839

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Available files

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