Vitas-M small molecule compound

(5Z)-5-(1,3-benzodioxol-5-ylmethylidene)-3-(3-nitrophenyl)-2-thioxo-1,3-thiazolidin-4-one

Catalog ID
STL416996
SMILES S=C1S/C(=C\c2ccc3c(c2)OCO3)/C(=O)N1c1cccc(c1)[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 C17H10N2O5S2 MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10N2O5S2/c20-16-15(7-10-4-5-13-14(6-10)24-9-23-13)26-17(25)18(16)11-2-1-3-12(8-11)19(21)22/h1-8H,9H2/b15-7-
InChIKey
VLFCBYOIXMRLLM-CHHVJCJISA-N
Synonyms

(5Z)5(13BENZODIOXOL5YLMETHYLIDENE)3(3NITROPHENYL)2SULFANYLIDENE13THIAZOLIDIN4ONE
(5Z)5(13benzodioxol5ylmethylidene)3(3nitrophenyl)2thioxo13thiazolidin4one
C1OC2=C(O1)C=C(C=C2)C=C3C(=O)N(C(=S)S3)C4=CC(=CC=C4)(N+)(=O)(O)
InChI=1SC17H10N2O5S2c201615(710451314(610)2492313)2617(25)18(16)1121312(811)19(21)22h18H9H2b157
MFCD01590534
S=C1SC(=Cc2ccc3c(c2)OCO3)C(=O)N1c1cccc(c1)(N+)(=O)(O)
ZINC000001193578
ZINC01193578
ZINC1193578

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Available files

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