Vitas-M small molecule compound

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

Catalog ID
STK995645
SMILES OC(=O)CCC(N1C(=S)S/C(=C\c2ccnc3c2cccc3)/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 C18H14N2O5S2 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O5S2/c21-15(22)6-5-13(17(24)25)20-16(23)14(27-18(20)26)9-10-7-8-19-12-4-2-1-3-11(10)12/h1-4,7-9,13H,5-6H2,(H,21,22)(H,24,25)/b14-9-
InChIKey
KZMILANJCUWEQX-ZROIWOOFSA-N
Synonyms

(Z)2(4oxo5(quinolin4ylmethylene)2thioxothiazolidin3yl)pentanedioicacid
2((5Z)4oxo5(quinolin4ylmethylidene)2sulfanylidene13thiazolidin3yl)pentanedioicacid
2((5Z)4oxo5(quinolin4ylmethylidene)2thioxo13thiazolidin3yl)pentanedioicacid
2(4OXO5(4QUINOLYLMETHYLENE)2THIOXO13THIAZOLIDIN3YL)PENTANEDIOICACID
C1=CC=C2C(=C1)C(=CC=N2)C=C3C(=O)N(C(=S)S3)C(CCC(=O)O)C(=O)O
InChI=1SC18H14N2O5S2c2115(22)6513(17(24)25)2016(23)14(2718(20)26)910781912421311(10)12h147913H56H2(H2122)(H2425)b149
MFCD09847364
OC(=O)CCC(N1C(=S)SC(=Cc2ccnc3c2cccc3)C1=O)C(=O)O
ZINC000009423874
ZINC000009423875

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Available files

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