Vitas-M small molecule compound
[(2E)-2-[(2Z)-2-(3-ethyl-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene)ethylidene]-1,3-benzothiazol-3(2H)-yl]acetic acid
Catalog ID
STK325954
SMILES CCN1C(=S)S/C(=C\C=c/2\sc3c(n2CC(=O)O)cccc3)/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 C16H14N2O3S3 MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O3S3/c1-2-17-15(21)12(24-16(17)22)7-8-13-18(9-14(19)20)10-5-3-4-6-11(10)23-13/h3-8H,2,9H2,1H3,(H,19,20)/b12-7-,13-8+InChIKey
NLOIFXKNOLUCMT-HAKHBUOSSA-NSynonyms
((2E)2((2Z)2(3ethyl4oxo2thioxo13thiazolidin5ylidene)ethylidene)13benzothiazol3(2H)yl)aceticacid
2((2E)2((2Z)2(3ETHYL4OXO2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)ETHYLIDENE)13BENZOTHIAZOL3YL)ACETICACID
CCN1C(=O)C(=CC=C2N(C3=CC=CC=C3S2)CC(=O)O)SC1=S
CCN1C(=S)SC(=CC=c2sc3c(n2CC(=O)O)cccc3)C1=O
InChI=1SC16H14N2O3S3c121715(21)12(2416(17)22)781318(914(19)20)10534611(10)2313h38H29H21H3(H1920)b127138+
MFCD00385675
ZINC000002818373
ZINC2818373
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