Vitas-M small molecule compound
N-(furan-2-ylmethyl)-2-{[5-(propan-2-ylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}acetamide
Catalog ID
STK939873
SMILES O=C(NCc1ccco1)CSc1nnc2n1c(SC(C)C)nc1c2c2CCCCc2s1
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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 C21H23N5O2S3 MW 473.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S3/c1-12(2)30-20-23-19-17(14-7-3-4-8-15(14)31-19)18-24-25-21(26(18)20)29-11-16(27)22-10-13-6-5-9-28-13/h5-6,9,12H,3-4,7-8,10-11H2,1-2H3,(H,22,27)InChIKey
VELGZPKQLVRKPE-UHFFFAOYSA-NSynonyms
877781-82-3877781823
CC(C)SC1=NC2=C(C3=C(S2)CCCC3)C4=NN=C(N41)SCC(=O)NCC5=CC=CO5
InChI=1SC21H23N5O2S3c112(2)3020231917(14734815(14)3119)18242521(26(18)20)291116(27)2210136592813h56912H34781011H212H3(H2227)
MFCD05700529
N(furan2ylmethyl)2((5(isopropylthio)891011tetrahydrobenzo(45)thieno(32e)(124)triazolo(43c)pyrimidin3yl)thio)acetamide
N(furan2ylmethyl)2((5(propan2ylsulfanyl)891011tetrahydro(1)benzothieno(32e)(124)triazolo(43c)pyrimidin3yl)sulfanyl)acetamide
ZINC000004295381
ZINC04295381
ZINC4295381
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