Vitas-M small molecule compound
(3Z)-1,7-dimethyl-5-nitro-3-(4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)-1,3-dihydro-2H-indol-2-one
Catalog ID
STK873680
SMILES S=C1NC(=O)/C(=C\2/C(=O)N(c3c2cc(cc3C)[N+](=O)[O-])C)/S1
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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 C13H9N3O4S2 MW 335.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9N3O4S2/c1-5-3-6(16(19)20)4-7-8(12(18)15(2)9(5)7)10-11(17)14-13(21)22-10/h3-4H,1-2H3,(H,14,17,21)/b10-8-InChIKey
PTVHAZATTJHIIE-NTMALXAHSA-NSynonyms
(3Z)17dimethyl5nitro3(4oxo2thioxo13thiazolidin5ylidene)13dihydro2Hindol2one
(5Z)5(17DIMETHYL5NITRO2OXOINDOL3YLIDENE)2SULFANYLIDENE13THIAZOLIDIN4ONE
(Z)5(17dimethyl5nitro2oxoindolin3ylidene)2thioxothiazolidin4one
CC1=C2C(=CC(=C1)(N+)(=O)(O))C(=C3C(=O)NC(=S)S3)C(=O)N2C
InChI=1SC13H9N3O4S2c1536(16(19)20)478(12(18)15(2)9(5)7)1011(17)1413(21)2210h34H12H3(H141721)b108
MFCD00565654
S=C1NC(=O)C(=C2C(=O)N(c3c2cc(cc3C)(N+)(=O)(O))C)S1
ZINC000004834250
ZINC04834250
ZINC4834250
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