Vitas-M small molecule compound

(2E)-2-(1H-benzimidazol-2-yl)-3-{5-[(4-methylphenyl)sulfanyl]furan-2-yl}prop-2-enenitrile

Catalog ID
STK195671
SMILES N#C/C(=C\c1ccc(o1)Sc1ccc(cc1)C)/c1nc2c([nH]1)cccc2

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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 C21H15N3OS MW 357.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15N3OS/c1-14-6-9-17(10-7-14)26-20-11-8-16(25-20)12-15(13-22)21-23-18-4-2-3-5-19(18)24-21/h2-12H,1H3,(H,23,24)/b15-12+
InChIKey
ADWONHQOLUQKLU-NTCAYCPXSA-N
Synonyms

(2E)2(1HBENZIMIDAZOL2YL)3(5((4METHYLPHENYL)SULFANYL)FURAN2YL)PROP2ENENITRILE
(E)2(1HBENZIMIDAZOL2YL)3(5(4METHYLPHENYL)SULFANYLFURAN2YL)PROP2ENENITRILE
CC1=CC=C(C=C1)SC2=CC=C(O2)C=C(C#N)C3=NC4=CC=CC=C4N3
InChI=1SC21H15N3OSc1146917(10714)262011816(2520)1215(1322)212318423519(18)2421h212H1H3(H2324)b1512+
MFCD02778508
N#CC(=Cc1ccc(o1)Sc1ccc(cc1)C)c1nc2c((nH)1)cccc2
ZINC000004705563
ZINC04705563
ZINC4705563

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Available files

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