Vitas-M small molecule compound
methyl 3-isothiocyanato-1-(2-methoxy-2-oxoethyl)-4-phenyl-1H-pyrrole-2-carboxylate
Catalog ID
STL133164
SMILES S=C=Nc1c(C(=O)OC)n(cc1c1ccccc1)CC(=O)OC
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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 C16H14N2O4S MW 330.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O4S/c1-21-13(19)9-18-8-12(11-6-4-3-5-7-11)14(17-10-23)15(18)16(20)22-2/h3-8H,9H2,1-2H3InChIKey
DFPJBTDRKVNITL-UHFFFAOYSA-NSynonyms
1313845-36-11313845361
COC(=O)CN1C=C(C(=C1C(=O)OC)N=C=S)C2=CC=CC=C2
InChI=1SC16H14N2O4Sc12113(19)918812(116435711)14(171023)15(18)16(20)222h38H9H212H3
methyl3isothiocyanato1(2methoxy2oxoethyl)4phenyl1Hpyrrole2carboxylate
methyl3isothiocyanato1(2methoxy2oxoethyl)4phenylpyrrole2carboxylate
MFCD19705971
ZINC000067172897
ZINC67172897
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