Vitas-M small molecule compound

(4E)-4-[(9-ethyl-9H-carbazol-3-yl)methylidene]-2-[4-(4-methylphenyl)-1,3-thiazol-2-yl]-5-(4-nitrophenyl)-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK100169
SMILES CCn1c2ccc(cc2c2c1cccc2)/C=C/1\C(=NN(C1=O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)[N+](=O)[O-]

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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 C34H25N5O3S MW 583.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H25N5O3S/c1-3-37-30-7-5-4-6-26(30)27-18-22(10-17-31(27)37)19-28-32(24-13-15-25(16-14-24)39(41)42)36-38(33(28)40)34-35-29(20-43-34)23-11-8-21(2)9-12-23/h4-20H,3H2,1-2H3/b28-19+
InChIKey
GHHIIFXHMJRLAO-TURZUDJPSA-N
Synonyms

(4E)4((9ETHYL9HCARBAZOL3YL)METHYLIDENE)2(4(4METHYLPHENYL)13THIAZOL2YL)5(4NITROPHENYL)24DIHYDRO3HPYRAZOL3ONE
(4E)4((9ETHYLCARBAZOL3YL)METHYLIDENE)2(4(4METHYLPHENYL)13THIAZOL2YL)5(4NITROPHENYL)PYRAZOL3ONE
4((9ETHYL9HCARBAZOL3YL)METHYLENE)5(4NITROPHENYL)2(4(4METHYLPHENYL)13THIAZOL2YL)24DIHYDRO3HPYRAZOL3ONE
4((9ETHYLCARBAZOL3YL)METHYLENE)1(4(4METHYLPHENYL)(13THIAZOL2YL))3(4NITROPHENYL)12DIAZOLIN5ONE
CCN1C2=C(C=C(C=C2)C=C3C(=NN(C3=O)C4=NC(=CS4)C5=CC=C(C=C5)C)C6=CC=C(C=C6)(N+)(=O)(O))C7=CC=CC=C71
CCn1c2ccc(cc2c2c1cccc2)C=C1C(=NN(C1=O)c1scc(n1)c1ccc(cc1)C)c1ccc(cc1)(N+)(=O)(O)
InChI=1SC34H25N5O3Sc133730754626(30)271822(101731(27)37)192832(24131525(161424)39(41)42)3638(33(28)40)343529(204334)2311821(2)91223h420H3H212H3b2819+
MFCD01630506
ZINC000004046920
ZINC04046920
ZINC4046920

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Available files

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