Vitas-M small molecule compound
(2E)-2-{[3-(4-methylphenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STK821500
SMILES C=CCNC(=S)N/N=C/c1cn(nc1c1ccc(cc1)C)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 C21H21N5S MW 375.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N5S/c1-3-13-22-21(27)24-23-14-18-15-26(19-7-5-4-6-8-19)25-20(18)17-11-9-16(2)10-12-17/h3-12,14-15H,1,13H2,2H3,(H2,22,24,27)/b23-14+InChIKey
BFMDDLPPSKVHHL-OEAKJJBVSA-NSynonyms
(2E)2((3(4methylphenyl)1phenyl1Hpyrazol4yl)methylidene)N(prop2en1yl)hydrazinecarbothioamide
1((E)(3(4methylphenyl)1phenylpyrazol4yl)methylideneamino)3prop2enylthiourea
C=CCNC(=S)NN=Cc1cn(nc1c1ccc(cc1)C)c1ccccc1
CC1=CC=C(C=C1)C2=NN(C=C2C=NNC(=S)NCC=C)C3=CC=CC=C3
InChI=1SC21H21N5Sc13132221(27)242314181526(197546819)2520(18)1711916(2)101217h3121415H113H22H3(H2222427)b2314+
MFCD03462847
ZINC000026964681
ZINC102854741
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