Vitas-M small molecule compound

2-{[4-cyano-1-(pyrrolidin-1-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]sulfanyl}acetamide

Catalog ID
STK613798
SMILES N#Cc1c(SCC(=O)N)nc(c2c1CCCC2)N1CCCC1

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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 C16H20N4OS MW 316.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4OS/c17-9-13-11-5-1-2-6-12(11)15(20-7-3-4-8-20)19-16(13)22-10-14(18)21/h1-8,10H2,(H2,18,21)
InChIKey
ZUXHCYZFMGGZSN-UHFFFAOYSA-N
Synonyms
903200-76-0
2((4cyano1(pyrrolidin1yl)5678tetrahydroisoquinolin3yl)sulfanyl)acetamide
2((4cyano1(pyrrolidin1yl)5678tetrahydroisoquinolin3yl)thio)acetamide
2((4cyano1pyrrolidin1yl5678tetrahydroisoquinolin3yl)sulfanyl)acetamide
903200760
C1CCC2=C(N=C(C(=C2C1)C#N)SCC(=O)N)N3CCCC3
InChI=1SC16H20N4OSc1791311512612(11)15(20734820)1916(13)221014(18)21h1810H2(H21821)
MFCD08285592
ZINC000020573185
ZINC20573185

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.