Vitas-M small molecule compound
4-[(1-benzyl-1H-benzimidazol-2-yl)sulfanyl]but-2-yn-1-yl 4-chlorobenzoate
Catalog ID
STK208531
SMILES Clc1ccc(cc1)C(=O)OCC#CCSc1nc2c(n1Cc1ccccc1)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 C25H19ClN2O2S MW 446.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19ClN2O2S/c26-21-14-12-20(13-15-21)24(29)30-16-6-7-17-31-25-27-22-10-4-5-11-23(22)28(25)18-19-8-2-1-3-9-19/h1-5,8-15H,16-18H2InChIKey
QJWUXPBUGSWROC-UHFFFAOYSA-NSynonyms
4((1BENZYL1HBENZIMIDAZOL2YL)SULFANYL)BUT2YN1YL4CHLOROBENZOATE
4(1benzylbenzimidazol2yl)sulfanylbut2ynyl4chlorobenzoate
C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2SCC#CCOC(=O)C4=CC=C(C=C4)Cl
InChI=1SC25H19ClN2O2Sc2621141220(131521)24(29)301667173125272210451123(22)28(25)18198213919h15815H1618H2
MFCD04385779
ZINC000009546467
ZINC09546467
ZINC9546467
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