Vitas-M small molecule compound
N-(3-cyano-4,5,6,7,8,9-hexahydrocycloocta[b]thiophen-2-yl)-2-{[5-(furan-2-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK473983
SMILES N#Cc1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccco2)sc2c1CCCCCC2
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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 C24H27N5O3S2 MW 497.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O3S2/c25-13-18-17-8-3-1-2-4-10-20(17)34-23(18)26-21(30)15-33-24-28-27-22(19-9-6-12-32-19)29(24)14-16-7-5-11-31-16/h6,9,12,16H,1-5,7-8,10-11,14-15H2,(H,26,30)InChIKey
QMDUSFKNUUDFGL-UHFFFAOYSA-NSynonyms
C1CCCC2=C(CC1)C(=C(S2)NC(=O)CSC3=NN=C(N3CC4CCCO4)C5=CC=CO5)C#N
InChI=1SC24H27N5O3S2c25131817831241020(17)3423(18)2621(30)153324282722(1996123219)29(24)141675113116h691216H157810111415H2(H2630)
MFCD06033282
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)2((5(furan2yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetamide
N(3cyano456789hexahydrocycloocta(b)thiophen2yl)2((5(furan2yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000020479736
ZINC000020479738
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