Vitas-M small molecule compound
methyl 3-isothiocyanato-5-methyl-1H-pyrrole-2-carboxylate
Catalog ID
STL105621
SMILES S=C=Nc1cc([nH]c1C(=O)OC)C
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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 C8H8N2O2S MW 196.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H8N2O2S/c1-5-3-6(9-4-13)7(10-5)8(11)12-2/h3,10H,1-2H3InChIKey
PRKDJQGHEQKTOO-UHFFFAOYSA-NSynonyms
1255785-97-71255785977
CC1=CC(=C(N1)C(=O)OC)N=C=S
InChI=1SC8H8N2O2Sc1536(9413)7(105)8(11)122h310H12H3
methyl3isothiocyanato5methyl1Hpyrrole2carboxylate
MFCD17780410
S=C=Nc1cc((nH)c1C(=O)OC)C
ZINC000057352374
ZINC57352374
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