Vitas-M small molecule compound
2-{(1E)-1-[4-hydroxy-2,6-dioxo-1-(prop-2-en-1-yl)-1,6-dihydropyrimidin-5(2H)-ylidene]propyl}-N-phenylhydrazinecarbothioamide
Catalog ID
STK571248
SMILES C=CCN1C(=O)N=C(/C(=C(\NNC(=S)Nc2ccccc2)/CC)/C1=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 C17H19N5O3S MW 373.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N5O3S/c1-3-10-22-15(24)13(14(23)19-17(22)25)12(4-2)20-21-16(26)18-11-8-6-5-7-9-11/h3,5-9,20H,1,4,10H2,2H3,(H2,18,21,26)(H,19,23,25)/b13-12+InChIKey
VZUVHVQZSXIWCL-OUKQBFOZSA-NSynonyms
1PHENYL3(((1E)1(246TRIOXO1PROP2ENYL13DIAZINAN5YLIDENE)PROPYL)AMINO)THIOUREA
2((1E)1(4hydroxy26dioxo1(prop2en1yl)16dihydropyrimidin5(2H)ylidene)propyl)Nphenylhydrazinecarbothioamide
C=CCN1C(=O)N=C(C(=C(NNC(=S)Nc2ccccc2)CC)C1=O)O
CCC(=C1C(=O)NC(=O)N(C1=O)CC=C)NNC(=S)NC2=CC=CC=C2
InChI=1SC17H19N5O3Sc13102215(24)13(14(23)1917(22)25)12(42)202116(26)18118657911h35920H1410H22H3(H2182126)(H192325)b1312+
MFCD07199295
ZINC000013865273
ZINC13865273
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