Vitas-M small molecule compound
3-[(2Z)-2-{1-[5-(4-methoxyphenyl)-1,3-thiazol-2-yl]-5-oxo-3-phenyl-1,5-dihydro-4H-pyrazol-4-ylidene}hydrazinyl]benzoic acid
Catalog ID
STK039699
SMILES COc1ccc(cc1)c1cnc(s1)N1N=C(/C(=N/Nc2cccc(c2)C(=O)O)/C1=O)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 C26H19N5O4S MW 497.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N5O4S/c1-35-20-12-10-16(11-13-20)21-15-27-26(36-21)31-24(32)23(22(30-31)17-6-3-2-4-7-17)29-28-19-9-5-8-18(14-19)25(33)34/h2-15,28H,1H3,(H,33,34)/b29-23-InChIKey
ISECWEUOGGGRJG-FAJYDZGRSA-NSynonyms
3((2Z)2(1(5(4METHOXYPHENYL)13THIAZOL2YL)5OXO3PHENYL15DIHYDRO4HPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
3((2Z)2(1(5(4METHOXYPHENYL)13THIAZOL2YL)5OXO3PHENYLPYRAZOL4YLIDENE)HYDRAZINYL)BENZOICACID
COC1=CC=C(C=C1)C2=CN=C(S2)N3C(=O)C(=NNC4=CC=CC(=C4)C(=O)O)C(=N3)C5=CC=CC=C5
COc1ccc(cc1)c1cnc(s1)N1N=C(C(=NNc2cccc(c2)C(=O)O)C1=O)c1ccccc1
InChI=1SC26H19N5O4Sc13520121016(111320)21152726(3621)3124(32)23(22(3031)176324717)29281995818(1419)25(33)34h21528H1H3(H3334)b2923
MFCD08050628
STK039699
ZINC000013942336
ZINC101426339
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