Vitas-M small molecule compound
(2E)-2-{3-[(1H-benzimidazol-2-ylsulfanyl)methyl]-4-methoxybenzylidene}-N-phenylhydrazinecarbothioamide
Catalog ID
STL168712
SMILES COc1ccc(cc1CSc1nc2c([nH]1)cccc2)/C=N/NC(=S)Nc1ccccc1
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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 C23H21N5OS2 MW 447.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N5OS2/c1-29-21-12-11-16(14-24-28-22(30)25-18-7-3-2-4-8-18)13-17(21)15-31-23-26-19-9-5-6-10-20(19)27-23/h2-14H,15H2,1H3,(H,26,27)(H2,25,28,30)/b24-14+InChIKey
MXKPRWUUTPBDAL-ZVHZXABRSA-NSynonyms
527699-32-7(2E)2(3((1Hbenzimidazol2ylsulfanyl)methyl)4methoxybenzylidene)Nphenylhydrazinecarbothioamide
(E)2(3(((1Hbenzo(d)imidazol2yl)thio)methyl)4methoxybenzylidene)Nphenylhydrazinecarbothioamide
1((E)(3(1HBENZIMIDAZOL2YLSULFANYLMETHYL)4METHOXYPHENYL)METHYLIDENEAMINO)3PHENYLTHIOUREA
527699327
COC1=C(C=C(C=C1)C=NNC(=S)NC2=CC=CC=C2)CSC3=NC4=CC=CC=C4N3
COc1ccc(cc1CSc1nc2c((nH)1)cccc2)C=NNC(=S)Nc1ccccc1
InChI=1SC23H21N5OS2c12921121116(14242822(30)25187324818)1317(21)15312326199561020(19)2723h214H15H21H3(H2627)(H2252830)b2414+
MFCD03553052
ZINC000002214476
ZINC33350611
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