Vitas-M small molecule compound
(5Z)-5-[3-(2,4-dinitrophenoxy)benzylidene]-3-(naphthalen-2-ylmethyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STL380374
SMILES O=C1S/C(=C\c2cccc(c2)Oc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-])/C(=O)N1Cc1ccc2c(c1)cccc2
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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 C27H17N3O7S MW 527.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H17N3O7S/c31-26-25(38-27(32)28(26)16-18-8-9-19-5-1-2-6-20(19)12-18)14-17-4-3-7-22(13-17)37-24-11-10-21(29(33)34)15-23(24)30(35)36/h1-15H,16H2/b25-14-InChIKey
LZRMDWOOXIXAKV-QFEZKATASA-NSynonyms
(5Z)5((3(24dinitrophenoxy)phenyl)methylidene)3(naphthalen2ylmethyl)13thiazolidine24dione
(5Z)5(3(24dinitrophenoxy)benzylidene)3(naphthalen2ylmethyl)13thiazolidine24dione
C1=CC=C2C=C(C=CC2=C1)CN3C(=O)C(=CC4=CC(=CC=C4)OC5=C(C=C(C=C5)(N+)(=O)(O))(N+)(=O)(O))SC3=O
InChI=1SC27H17N3O7Sc312625(3827(32)28(26)16188919512620(19)1218)141743722(1317)3724111021(29(33)34)1523(24)30(35)36h115H16H2b2514
MFCD28951071
O=C1SC(=Cc2cccc(c2)Oc2ccc(cc2(N+)(=O)(O))(N+)(=O)(O))C(=O)N1Cc1ccc2c(c1)cccc2
ZINC000105981050
ZINC105981050
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