Vitas-M small molecule compound
4-(1,3-benzoxazol-2-ylsulfanyl)but-2-yn-1-yl 3-chloro-1-benzothiophene-2-carboxylate
Catalog ID
STK177454
SMILES O=C(c1sc2c(c1Cl)cccc2)OCC#CCSc1nc2c(o1)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 C20H12ClNO3S2 MW 413.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H12ClNO3S2/c21-17-13-7-1-4-10-16(13)27-18(17)19(23)24-11-5-6-12-26-20-22-14-8-2-3-9-15(14)25-20/h1-4,7-10H,11-12H2InChIKey
YJERXRNRTHIMLZ-UHFFFAOYSA-NSynonyms
669715-60-04(13BENZOXAZOL2YLSULFANYL)BUT2YN1YL3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4(13BENZOXAZOL2YLSULFANYL)BUT2YNYL3CHLORO1BENZOTHIOPHENE2CARBOXYLATE
4(benzo(d)oxazol2ylthio)but2yn1yl3chlorobenzo(b)thiophene2carboxylate
669715600
C1=CC=C2C(=C1)C(=C(S2)C(=O)OCC#CCSC3=NC4=CC=CC=C4O3)Cl
InChI=1SC20H12ClNO3S2c2117137141016(13)2718(17)19(23)2411561226202214823915(14)2520h14710H1112H2
MFCD03662947
ZINC000002364135
ZINC02364135
ZINC2364135
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