Vitas-M small molecule compound
N-[(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]-4-nitrobenzamide
Catalog ID
STK836771
SMILES S=C1S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1NC(=O)c1ccc(cc1)[N+](=O)[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 C18H11N3O6S2 MW 429.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H11N3O6S2/c22-16(11-2-4-12(5-3-11)21(24)25)19-20-17(23)15(29-18(20)28)8-10-1-6-13-14(7-10)27-9-26-13/h1-8H,9H2,(H,19,22)/b15-8-InChIKey
GSUMIPUTMQURSK-NVNXTCNLSA-NSynonyms
380574-04-9(Z)N(5(benzo(d)(13)dioxol5ylmethylene)4oxo2thioxothiazolidin3yl)4nitrobenzamide
380574049
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)S3)NC(=O)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC18H11N3O6S2c2216(112412(5311)21(24)25)192017(23)15(2918(20)28)810161314(710)2792613h18H9H2(H1922)b158
MFCD02334813
N((5Z)5(13BENZODIOXOL5YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)4NITROBENZAMIDE
N((5Z)5(13benzodioxol5ylmethylidene)4oxo2thioxo13thiazolidin3yl)4nitrobenzamide
N(5(2HBENZO(34D)13DIOXOLEN5YLMETHYLENE)4OXO2THIOXO(13THIAZOLIDIN3YL))(4NITROPHENYL)CARBOXAMIDE
S=C1SC(=Cc2ccc3c(c2)OCO3)C(=O)N1NC(=O)c1ccc(cc1)(N+)(=O)(O)
ZINC000001831906
ZINC01831906
ZINC1831906
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