Vitas-M small molecule compound
methyl N-{[2-(1H-tetrazol-1-yl)-4,5,6,7-tetrahydro-1-benzothiophen-3-yl]carbonyl}methioninate
Catalog ID
STL160969
SMILES CSCCC(C(=O)OC)NC(=O)c1c(sc2c1CCCC2)n1cnnn1
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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 C16H21N5O3S2 MW 395.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N5O3S2/c1-24-16(23)11(7-8-25-2)18-14(22)13-10-5-3-4-6-12(10)26-15(13)21-9-17-19-20-21/h9,11H,3-8H2,1-2H3,(H,18,22)InChIKey
NOYGPWRQXWMTKC-UHFFFAOYSA-NSynonyms
(R)methyl2(2(1Htetrazol1yl)4567tetrahydrobenzo(b)thiophene3carboxamido)4(methylthio)butanoate
COC(=O)C(CCSC)NC(=O)C1=C(SC2=C1CCCC2)N3C=NN=N3
CSCC(C@H)(C(=O)OC)NC(=O)c1c(sc2c1CCCC2)n1cnnn1
InChI=1SC16H21N5O3S2c12416(23)11(78252)1814(22)1310534612(10)2615(13)21917192021h911H38H212H3(H1822)
methyl4methylsulfanyl2((2(tetrazol1yl)4567tetrahydro1benzothiophene3carbonyl)amino)butanoate
methylN((2(1Htetrazol1yl)4567tetrahydro1benzothiophen3yl)carbonyl)methioninate
MFCD20759210
ZINC000061719133
ZINC000071334756
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