Vitas-M small molecule compound
(5Z)-5-[3-chloro-5-methoxy-4-(prop-2-yn-1-yloxy)benzylidene]-3-propyl-2-thioxoimidazolidin-4-one
Catalog ID
STL375112
SMILES CCCN1C(=S)N/C(=C\c2cc(Cl)c(c(c2)OC)OCC#C)/C1=O
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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 C17H17ClN2O3S MW 364.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN2O3S/c1-4-6-20-16(21)13(19-17(20)24)9-11-8-12(18)15(23-7-5-2)14(10-11)22-3/h2,8-10H,4,6-7H2,1,3H3,(H,19,24)/b13-9-InChIKey
RVGOVKMAPHNPST-LCYFTJDESA-NSynonyms
(5Z)5((3CHLORO5METHOXY4PROP2YNOXYPHENYL)METHYLIDENE)3PROPYL2SULFANYLIDENEIMIDAZOLIDIN4ONE
(5Z)5(3chloro5methoxy4(prop2yn1yloxy)benzylidene)3propyl2thioxoimidazolidin4one
CCCN1C(=O)C(=CC2=CC(=C(C(=C2)Cl)OCC#C)OC)NC1=S
CCCN1C(=S)NC(=Cc2cc(Cl)c(c(c2)OC)OCC#C)C1=O
InChI=1SC17H17ClN2O3Sc1462016(21)13(1917(20)24)911812(18)15(23752)14(1011)223h2810H467H213H3(H1924)b139
MFCD04086882
ZINC000003662687
ZINC03662687
ZINC3662687
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