Vitas-M small molecule compound

methyl {(5Z)-5-[4-(diethylamino)benzylidene]-3-methyl-4-oxo-2-thioxoimidazolidin-1-yl}acetate

Catalog ID
STL416484
SMILES CCN(c1ccc(cc1)/C=C/1\N(CC(=O)OC)C(=S)N(C1=O)C)CC

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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 C18H23N3O3S MW 361.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H23N3O3S/c1-5-20(6-2)14-9-7-13(8-10-14)11-15-17(23)19(3)18(25)21(15)12-16(22)24-4/h7-11H,5-6,12H2,1-4H3/b15-11-
InChIKey
SHNRTMBRSNTDHI-PTNGSMBKSA-N
Synonyms

CCN(c1ccc(cc1)C=C1N(CC(=O)OC)C(=S)N(C1=O)C)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)N(C(=S)N2CC(=O)OC)C
InChI=1SC18H23N3O3Sc1520(62)149713(81014)111517(23)19(3)18(25)21(15)1216(22)244h711H5612H214H3b1511
methyl((5Z)5(4(diethylamino)benzylidene)3methyl4oxo2thioxoimidazolidin1yl)acetate
METHYL2((5Z)5((4(DIETHYLAMINO)PHENYL)METHYLIDENE)3METHYL4OXO2SULFANYLIDENEIMIDAZOLIDIN1YL)ACETATE
MFCD03721098
ZINC000002829096
ZINC02829096
ZINC2829096

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Available files

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