Vitas-M small molecule compound
(5Z)-3-cyclohexyl-5-[3-methyl-4-(pyrrolidin-1-yl)benzylidene]-2-thioxoimidazolidin-4-one
Catalog ID
STL375220
SMILES S=C1N/C(=C\c2ccc(c(c2)C)N2CCCC2)/C(=O)N1C1CCCCC1
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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 C21H27N3OS MW 369.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N3OS/c1-15-13-16(9-10-19(15)23-11-5-6-12-23)14-18-20(25)24(21(26)22-18)17-7-3-2-4-8-17/h9-10,13-14,17H,2-8,11-12H2,1H3,(H,22,26)/b18-14-InChIKey
HGJRSIBTGNTPCF-JXAWBTAJSA-NSynonyms
(5Z)3CYCLOHEXYL5((3METHYL4PYRROLIDIN1YLPHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3cyclohexyl5(3methyl4(pyrrolidin1yl)benzylidene)2thioxoimidazolidin4one
CC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)N2)C3CCCCC3)N4CCCC4
InChI=1SC21H27N3OSc1151316(91019(15)2311561223)141820(25)24(21(26)2218)177324817h910131417H281112H21H3(H2226)b1814
MFCD04086934
S=C1NC(=Cc2ccc(c(c2)C)N2CCCC2)C(=O)N1C1CCCCC1
ZINC000003662917
ZINC03662917
ZINC3662917
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