Vitas-M small molecule compound

(4Z)-5-methyl-4-({3-[3-(morpholin-4-ylsulfonyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylidene)-2-phenyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK904791
SMILES CC1=NN(C(=O)/C/1=C\c1cn(nc1c1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccccc1)c1ccccc1

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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 C30H27N5O4S MW 553.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O4S/c1-22-28(30(36)35(31-22)26-12-6-3-7-13-26)20-24-21-34(25-10-4-2-5-11-25)32-29(24)23-9-8-14-27(19-23)40(37,38)33-15-17-39-18-16-33/h2-14,19-21H,15-18H2,1H3/b28-20-
InChIKey
CXPWGGOHRDIJDE-RRAHZORUSA-N
Synonyms

(4Z)5methyl4((3(3(morpholin4ylsulfonyl)phenyl)1phenyl1Hpyrazol4yl)methylidene)2phenyl24dihydro3Hpyrazol3one
(4Z)5METHYL4((3(3MORPHOLIN4YLSULFONYLPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)2PHENYLPYRAZOL3ONE
(Z)3methyl4((3(3(morpholinosulfonyl)phenyl)1phenyl1Hpyrazol4yl)methylene)1phenyl1Hpyrazol5(4H)one
CC1=NN(C(=O)C1=Cc1cn(nc1c1cccc(c1)S(=O)(=O)N1CCOCC1)c1ccccc1)c1ccccc1
CC1=NN(C(=O)C1=CC2=CN(N=C2C3=CC(=CC=C3)S(=O)(=O)N4CCOCC4)C5=CC=CC=C5)C6=CC=CC=C6
InChI=1SC30H27N5O4Sc12228(30(36)35(3122)26126371326)20242134(25104251125)3229(24)23981427(1923)40(3738)33151739181633h2141921H1518H21H3b2820
MFCD04176611
ZINC000097947343
ZINC97947343

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Available files

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