Vitas-M small molecule compound

methyl [(5Z)-3-methyl-5-(naphthalen-1-ylmethylidene)-4-oxo-2-thioxoimidazolidin-1-yl]acetate

Catalog ID
STL369426
SMILES COC(=O)CN1/C(=C\c2cccc3c2cccc3)/C(=O)N(C1=S)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 C18H16N2O3S MW 340.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16N2O3S/c1-19-17(22)15(20(18(19)24)11-16(21)23-2)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-10H,11H2,1-2H3/b15-10-
InChIKey
ZPIRJGZZASPXKZ-GDNBJRDFSA-N
Synonyms

CN1C(=O)C(=CC2=CC=CC3=CC=CC=C32)N(C1=S)CC(=O)OC
COC(=O)CN1C(=Cc2cccc3c2cccc3)C(=O)N(C1=S)C
InChI=1SC18H16N2O3Sc11917(22)15(20(18(19)24)1116(21)232)101385712634914(12)13h310H11H212H3b1510
methyl((5Z)3methyl5(naphthalen1ylmethylidene)4oxo2thioxoimidazolidin1yl)acetate
METHYL2((5Z)3METHYL5(NAPHTHALEN1YLMETHYLIDENE)4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD04086765
ZINC000000586383
ZINC00586383
ZINC586383

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Available files

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