Vitas-M small molecule compound
(5Z)-3-benzyl-5-[3-chloro-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-2-thioxoimidazolidin-4-one
Catalog ID
STL370082
SMILES C#CCOc1c(Cl)cc(cc1OC)/C=C/1\NC(=S)N(C1=O)Cc1ccccc1
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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 C21H17ClN2O3S MW 412.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3S/c1-3-9-27-19-16(22)10-15(12-18(19)26-2)11-17-20(25)24(21(28)23-17)13-14-7-5-4-6-8-14/h1,4-8,10-12H,9,13H2,2H3,(H,23,28)/b17-11-InChIKey
SBEGZSPMKXBICS-BOPFTXTBSA-NSynonyms
(5Z)3BENZYL5((3CHLORO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)3benzyl5(3chloro5methoxy4(prop2yn1yloxy)benzylidene)2thioxoimidazolidin4one
3BENZYL5(3CHLORO5METHOXY4(2PROPYNYLOXY)BENZYLIDENE)2THIOXO4IMIDAZOLIDINONE
C#CCOc1c(Cl)cc(cc1OC)C=C1NC(=S)N(C1=O)Cc1ccccc1
COC1=C(C(=CC(=C1)C=C2C(=O)N(C(=S)N2)CC3=CC=CC=C3)Cl)OCC#C
InChI=1SC21H17ClN2O3Sc139271916(22)1015(1218(19)262)111720(25)24(21(28)2317)13147546814h1481012H913H22H3(H2328)b1711
MFCD04151536
ZINC000002145923
ZINC02145923
ZINC2145923
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