Vitas-M small molecule compound
methyl [(3-cyano-5,6,7,8-tetrahydroquinolin-2-yl)sulfanyl]acetate
Catalog ID
STK097460
SMILES COC(=O)CSc1nc2CCCCc2cc1C#N
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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 C13H14N2O2S MW 262.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O2S/c1-17-12(16)8-18-13-10(7-14)6-9-4-2-3-5-11(9)15-13/h6H,2-5,8H2,1H3InChIKey
VTJFAQWPTSXAIP-UHFFFAOYSA-NSynonyms
COC(=O)CSC1=NC2=C(CCCC2)C=C1C#N
COC(=O)CSc1nc2CCCCc2cc1C#N
InChI=1SC13H14N2O2Sc11712(16)8181310(714)69423511(9)1513h6H258H21H3
methyl((3cyano5678tetrahydroquinolin2yl)sulfanyl)acetate
methyl2((3cyano5678tetrahydroquinolin2yl)sulfanyl)acetate
MFCD00487233
STK097460
ZINC000004080710
ZINC04080710
ZINC4080710
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