Vitas-M small molecule compound

1-[3'-(4-chlorophenyl)-4-ethyl-2-phenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazol]-5'-yl]ethanone

Catalog ID
STL006532
SMILES CCC1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccc(cc1)Cl)C(=O)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 C25H21ClN4OS MW 460.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN4OS/c1-3-23-21-11-7-8-12-22(21)25(29(27-23)19-9-5-4-6-10-19)30(28-24(32-25)17(2)31)20-15-13-18(26)14-16-20/h4-16H,3H2,1-2H3
InChIKey
ISWDUFIIGQAPFO-UHFFFAOYSA-N
Synonyms
668439-23-4
1(3(4chlorophenyl)4ethyl2phenyl2H3Hspiro(phthalazine12(134)thiadiazol)5yl)ethanone
1(4(4CHLOROPHENYL)4ETHYL2PHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2YL)ETHANONE
668439234
CCC1=NN(C2(C3=CC=CC=C31)N(N=C(S2)C(=O)C)C4=CC=C(C=C4)Cl)C5=CC=CC=C5
InChI=1SC25H21ClN4OSc13232111781222(21)25(29(2723)1995461019)30(2824(3225)17(2)31)20151318(26)141620h416H3H212H3
MFCD03669847
ZINC000013648567
ZINC000013648571

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Available files

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