Vitas-M small molecule compound

6-methyl-3-{4-methyl-3-[(4-phenylpiperazin-1-yl)sulfonyl]phenyl}[1,2,4]triazolo[3,4-a]phthalazine

Catalog ID
STL003175
SMILES Cc1nn2c(nnc2c2c1cccc2)c1ccc(c(c1)S(=O)(=O)N1CCN(CC1)c1ccccc1)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 C27H26N6O2S MW 498.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N6O2S/c1-19-12-13-21(26-28-29-27-24-11-7-6-10-23(24)20(2)30-33(26)27)18-25(19)36(34,35)32-16-14-31(15-17-32)22-8-4-3-5-9-22/h3-13,18H,14-17H2,1-2H3
InChIKey
GESKJQSUDSDRQL-UHFFFAOYSA-N
Synonyms
840512-45-0
6methyl3(4methyl3((4phenylpiperazin1yl)sulfonyl)phenyl)(124)triazolo(34a)phthalazine
6METHYL3(4METHYL3(4PHENYLPIPERAZIN1YL)SULFONYLPHENYL)(124)TRIAZOLO(34A)PHTHALAZINE
840512450
CC1=C(C=C(C=C1)C2=NN=C3N2N=C(C4=CC=CC=C43)C)S(=O)(=O)N5CCN(CC5)C6=CC=CC=C6
InChI=1SC27H26N6O2Sc119121321(262829272411761023(24)20(2)3033(26)27)1825(19)36(3435)32161431(151732)228435922h31318H1417H212H3
MFCD04009749
ZINC000002265902
ZINC02265902
ZINC2265902

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Available files

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