Vitas-M small molecule compound

4-ethyl-3'-(4-methylphenyl)-N,2-diphenyl-2H,3'H-spiro[phthalazine-1,2'-[1,3,4]thiadiazole]-5'-carboxamide

Catalog ID
STL006802
SMILES CCC1=NN(c2ccccc2)C2(c3c1cccc3)SC(=NN2c1ccc(cc1)C)C(=O)Nc1ccccc1

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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 C31H27N5OS MW 517.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H27N5OS/c1-3-28-26-16-10-11-17-27(26)31(35(33-28)24-14-8-5-9-15-24)36(25-20-18-22(2)19-21-25)34-30(38-31)29(37)32-23-12-6-4-7-13-23/h4-21H,3H2,1-2H3,(H,32,37)
InChIKey
YZQONUXZQZIHLT-UHFFFAOYSA-N
Synonyms
668439-58-5
4ethyl3(4methylphenyl)N2diphenyl2H3Hspiro(phthalazine12(134)thiadiazole)5carboxamide
4ETHYL4(4METHYLPHENYL)N2DIPHENYLSPIRO(134THIADIAZOLE51PHTHALAZINE)2CARBOXAMIDE
4ethylN2diphenyl3(ptolyl)2H3Hspiro(phthalazine12(134)thiadiazole)5carboxamide
668439585
CCC1=NN(C2(C3=CC=CC=C31)N(N=C(S2)C(=O)NC4=CC=CC=C4)C5=CC=C(C=C5)C)C6=CC=CC=C6
InChI=1SC31H27N5OSc1328261610111727(26)31(35(3328)24148591524)36(25201822(2)192125)3430(3831)29(37)3223126471323h421H3H212H3(H3237)
MFCD03672409
ZINC000009075664
ZINC000009075665

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Available files

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