Vitas-M small molecule compound

[(2E)-2-{(2Z)-2-[4-oxo-3-(prop-2-en-1-yl)-2-thioxo-1,3-thiazolidin-5-ylidene]ethylidene}-1,3-benzothiazol-3(2H)-yl]acetic acid

Catalog ID
STK396365
SMILES C=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 C17H14N2O3S3 MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O3S3/c1-2-9-18-16(22)13(25-17(18)23)7-8-14-19(10-15(20)21)11-5-3-4-6-12(11)24-14/h2-8H,1,9-10H2,(H,20,21)/b13-7-,14-8+
InChIKey
VHQVPCITHPUZCD-MFUUIURDSA-N
Synonyms

((2E)2((2Z)2(4oxo3(prop2en1yl)2thioxo13thiazolidin5ylidene)ethylidene)13benzothiazol3(2H)yl)aceticacid
2((2E)2((2Z)2(4OXO3PROP2ENYL2SULFANYLIDENE13THIAZOLIDIN5YLIDENE)ETHYLIDENE)13BENZOTHIAZOL3YL)ACETICACID
2(2(2(4OXO3PROP2ENYL2THIOXO13THIAZOLIDIN5YLIDENE)ETHYLIDENE)3HYDROBENZOTHIAZOL3YL)ACETICACID
C=CCN1C(=O)C(=CC=C2N(C3=CC=CC=C3S2)CC(=O)O)SC1=S
C=CCN1C(=S)SC(=CC=c2sc3c(n2CC(=O)O)cccc3)C1=O
InChI=1SC17H14N2O3S3c1291816(22)13(2517(18)23)781419(1015(20)21)11534612(11)2414h28H1910H2(H2021)b137148+
MFCD00375733
ZINC000003107228
ZINC3107228

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Available files

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