Vitas-M small molecule compound
{(3Z)-3-[3-(1,1-dioxidotetrahydrothiophen-3-yl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]-2-oxo-2,3-dihydro-1H-indol-1-yl}acetic acid
Catalog ID
STK702499
SMILES OC(=O)CN1C(=O)/C(=C/2\SC(=S)N(C2=O)C2CCS(=O)(=O)C2)/c2c1cccc2
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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 C17H14N2O6S3 MW 438.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O6S3/c20-12(21)7-18-11-4-2-1-3-10(11)13(15(18)22)14-16(23)19(17(26)27-14)9-5-6-28(24,25)8-9/h1-4,9H,5-8H2,(H,20,21)/b14-13-InChIKey
CFZYPETUCCSAHO-YPKPFQOOSA-NSynonyms
((3Z)3(3(11dioxidotetrahydrothiophen3yl)4oxo2thioxo13thiazolidin5ylidene)2oxo23dihydro1Hindol1yl)aceticacid
2((3Z)3(3(11DIOXOTHIOLAN3YL)4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)2OXOINDOL1YL)ACETICACID
C1CS(=O)(=O)CC1N2C(=O)C(=C3C4=CC=CC=C4N(C3=O)CC(=O)O)SC2=S
InChI=1SC17H14N2O6S3c2012(21)71811421310(11)13(15(18)22)1416(23)19(17(26)2714)95628(2425)89h149H58H2(H2021)b1413
MFCD03225718
OC(=O)CN1C(=O)C(=C2SC(=S)N(C2=O)C2CCS(=O)(=O)C2)c2c1cccc2
ZINC000015230937
ZINC000015230939
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