Vitas-M small molecule compound
3-[(E)-{2-[(pyridin-2-ylsulfanyl)acetyl]hydrazinylidene}methyl]phenyl 4-bromo-1-methyl-1H-pyrazole-5-carboxylate
Catalog ID
STK958313
SMILES O=C(CSc1ccccn1)N/N=C/c1cccc(c1)OC(=O)c1c(Br)cnn1C
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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 C19H16BrN5O3S MW 474.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN5O3S/c1-25-18(15(20)11-23-25)19(27)28-14-6-4-5-13(9-14)10-22-24-16(26)12-29-17-7-2-3-8-21-17/h2-11H,12H2,1H3,(H,24,26)/b22-10+InChIKey
JEKJGFNNQZCDCT-LSHDLFTRSA-NSynonyms
514219-37-5(3((E)((2PYRIDIN2YLSULFANYLACETYL)HYDRAZINYLIDENE)METHYL)PHENYL)4BROMO2METHYLPYRAZOLE3CARBOXYLATE
3((E)(2((pyridin2ylsulfanyl)acetyl)hydrazinylidene)methyl)phenyl4bromo1methyl1Hpyrazole5carboxylate
3(2((2PYRIDINYLSULFANYL)ACETYL)CARBOHYDRAZONOYL)PHENYL4BROMO1METHYL1HPYRAZOLE5CARBOXYLATE
514219375
CN1C(=C(C=N1)Br)C(=O)OC2=CC=CC(=C2)C=NNC(=O)CSC3=CC=CC=N3
InChI=1SC19H16BrN5O3Sc12518(15(20)112325)19(27)281464513(914)10222416(26)12291772382117h211H12H21H3(H2426)b2210+
MFCD02054073
O=C(CSc1ccccn1)NN=Cc1cccc(c1)OC(=O)c1c(Br)cnn1C
ZINC000000695785
ZINC33335429
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