Vitas-M small molecule compound
methyl 5-({[4-cyano-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}methyl)furan-2-carboxylate
Catalog ID
STK606495
SMILES COC(=O)c1ccc(o1)CSc1nc(N2CCCC2)c2c(c1C#N)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 C21H23N3O3S MW 397.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N3O3S/c1-26-21(25)18-9-8-14(27-18)13-28-20-17(12-22)15-6-2-3-7-16(15)19(23-20)24-10-4-5-11-24/h8-9H,2-7,10-11,13H2,1H3InChIKey
PKRLTOLMRYZZFQ-UHFFFAOYSA-NSynonyms
904499-96-3904499963
COC(=O)C1=CC=C(O1)CSC2=NC(=C3CCCCC3=C2C#N)N4CCCC4
InChI=1SC21H23N3O3Sc12621(25)189814(2718)13282017(1222)15623716(15)19(2320)2410451124h89H27101113H21H3
methyl5(((4cyano1(pyrrolidin1yl)5678tetrahydroisoquinolin3yl)sulfanyl)methyl)furan2carboxylate
methyl5(((4cyano1(pyrrolidin1yl)5678tetrahydroisoquinolin3yl)thio)methyl)furan2carboxylate
methyl5((4cyano1pyrrolidin1yl5678tetrahydroisoquinolin3yl)sulfanylmethyl)furan2carboxylate
MFCD08284844
ZINC000020572761
ZINC20572761
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Check stock on Vitas-MAvailable files
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