Vitas-M small molecule compound
3-{(5Z)-5-[(1-methyl-1H-pyrrol-3-yl)methylidene]-4-oxo-2-thioxo-1,3-thiazolidin-3-yl}propanoic acid
Catalog ID
STK995245
SMILES OC(=O)CCN1C(=S)S/C(=C\c2ccn(c2)C)/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 C12H12N2O3S2 MW 296.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12N2O3S2/c1-13-4-2-8(7-13)6-9-11(17)14(12(18)19-9)5-3-10(15)16/h2,4,6-7H,3,5H2,1H3,(H,15,16)/b9-6-InChIKey
MMEQTCQXHPLKCT-TWGQIWQCSA-NSynonyms
3((5Z)5((1methyl1Hpyrrol3yl)methylidene)4oxo2thioxo13thiazolidin3yl)propanoicacid
3((5Z)5((1METHYLPYRROL3YL)METHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PROPANOICACID
CN1C=CC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)O
InChI=1SC12H12N2O3S2c113428(713)6911(17)14(12(18)199)5310(15)16h2467H35H21H3(H1516)b96
MFCD18185180
OC(=O)CCN1C(=S)SC(=Cc2ccn(c2)C)C1=O
ZINC000027229368
ZINC27229368
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