Vitas-M small molecule compound

2-[(5Z)-5-(1H-indol-3-ylmethylidene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]pentanedioic acid

Catalog ID
STL233321
SMILES OC(=O)CCC(N1C(=S)S/C(=C\c2c[nH]c3c2cccc3)/C1=O)C(=O)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 C17H14N2O5S2 MW 390.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N2O5S2/c20-14(21)6-5-12(16(23)24)19-15(22)13(26-17(19)25)7-9-8-18-11-4-2-1-3-10(9)11/h1-4,7-8,12,18H,5-6H2,(H,20,21)(H,23,24)/b13-7-
InChIKey
VYFSJVGPUYEOJU-QPEQYQDCSA-N
Synonyms

(Z)2(5((1Hindol3yl)methylene)4oxo2thioxothiazolidin3yl)pentanedioicacid
2((5Z)5(1HINDOL3YLMETHYLIDENE)4OXO2SULFANYLIDENE13THIAZOLIDIN3YL)PENTANEDIOICACID
2((5Z)5(1Hindol3ylmethylidene)4oxo2thioxo13thiazolidin3yl)pentanedioicacid
C1=CC=C2C(=C1)C(=CN2)C=C3C(=O)N(C(=S)S3)C(CCC(=O)O)C(=O)O
InChI=1SC17H14N2O5S2c2014(21)6512(16(23)24)1915(22)13(2617(19)25)7981811421310(9)11h14781218H56H2(H2021)(H2324)b137
MFCD04161825
OC(=O)CCC(N1C(=S)SC(=Cc2c(nH)c3c2cccc3)C1=O)C(=O)O
ZINC000002406850
ZINC000002406852

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Available files

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