Vitas-M small molecule compound
3-[(5E)-5-(5-nitro-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]propanoic acid
Catalog ID
STL331751
SMILES OC(=O)CCN1C(=S)S/C(=C\2/C(=O)Nc3c2cc(cc3)[N+](=O)[O-])/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 C14H9N3O6S2 MW 379.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9N3O6S2/c18-9(19)3-4-16-13(21)11(25-14(16)24)10-7-5-6(17(22)23)1-2-8(7)15-12(10)20/h1-2,5H,3-4H2,(H,15,20)(H,18,19)/b11-10+InChIKey
UKZPSSCBUIMLRD-ZHACJKMWSA-NSynonyms
(E)3(5(5nitro2oxoindolin3ylidene)4oxo2thioxothiazolidin3yl)propanoicacid
3((5E)5(5nitro2oxo12dihydro3Hindol3ylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5E)5(5NITRO2OXO1HINDOL3YLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
3(5(5NITRO2OXO(1HBENZO(D)AZOLIN3YLIDENE))4OXO2THIOXO13THIAZOLIDIN3YL)PROPANOICACID
C1=CC2=C(C=C1(N+)(=O)(O))C(=C3C(=O)N(C(=S)S3)CCC(=O)O)C(=O)N2
InChI=1SC14H9N3O6S2c189(19)341613(21)11(2514(16)24)10756(17(22)23)128(7)1512(10)20h125H34H2(H1520)(H1819)b1110+
MFCD02165601
OC(=O)CCN1C(=S)SC(=C2C(=O)Nc3c2cc(cc3)(N+)(=O)(O))C1=O
ZINC000003959651
ZINC3959651
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