Vitas-M small molecule compound
(2E)-2-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-4-methoxybenzylidene}-N-(prop-2-en-1-yl)hydrazinecarbothioamide
Catalog ID
STL168710
SMILES C=CCNC(=S)N/N=C/c1ccc(c(c1)CSc1nc2c([nH]1)cccc2)OC
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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 C20H21N5OS2 MW 411.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5OS2/c1-3-10-21-19(27)25-22-12-14-8-9-18(26-2)15(11-14)13-28-20-23-16-6-4-5-7-17(16)24-20/h3-9,11-12H,1,10,13H2,2H3,(H,23,24)(H2,21,25,27)/b22-12+InChIKey
HGCSUXKSXYRFLK-WSDLNYQXSA-NSynonyms
527689-88-9(((1E)2(3(BENZIMIDAZOL2YLTHIOMETHYL)4METHOXYPHENYL)1AZAVINYL)AMINO)(PROP2ENYLAMINO)METHANE1THIONE
(2E)2(3((1Hbenzimidazol2ylsulfanyl)methyl)4methoxybenzylidene)N(prop2en1yl)hydrazinecarbothioamide
1((E)(3(1Hbenzimidazol2ylsulfanylmethyl)4methoxyphenyl)methylideneamino)3prop2enylthiourea
527689889
C=CCNC(=S)NN=Cc1ccc(c(c1)CSc1nc2c((nH)1)cccc2)OC
COC1=C(C=C(C=C1)C=NNC(=S)NCC=C)CSC2=NC3=CC=CC=C3N2
InChI=1SC20H21N5OS2c13102119(27)252212148918(262)15(1114)1328202316645717(16)2420h391112H11013H22H3(H2324)(H2212527)b2212+
MFCD03552710
ZINC000002743637
ZINC38202473
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