Vitas-M small molecule compound
2-{[5-(7-methoxy-1-benzofuran-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-1-(morpholin-4-yl)ethanone
Catalog ID
STK497593
SMILES C=CCn1c(SCC(=O)N2CCOCC2)nnc1c1cc2c(o1)c(OC)ccc2
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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 C20H22N4O4S MW 414.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O4S/c1-3-7-24-19(16-12-14-5-4-6-15(26-2)18(14)28-16)21-22-20(24)29-13-17(25)23-8-10-27-11-9-23/h3-6,12H,1,7-11,13H2,2H3InChIKey
ZBECEPPOBZDAOK-UHFFFAOYSA-NSynonyms
2((5(7methoxy1benzofuran2yl)4(prop2en1yl)4H124triazol3yl)sulfanyl)1(morpholin4yl)ethanone
2((5(7methoxy1benzofuran2yl)4prop2enyl124triazol3yl)sulfanyl)1morpholin4ylethanone
COC1=CC=CC2=C1OC(=C2)C3=NN=C(N3CC=C)SCC(=O)N4CCOCC4
InChI=1SC20H22N4O4Sc1372419(16121454615(262)18(14)2816)212220(24)291317(25)238102711923h3612H171113H22H3
MFCD11854977
ZINC000032579339
ZINC32579339
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