Vitas-M small molecule compound

4-hydroxy-N-[(5E)-4-oxo-5-(quinolin-6-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]benzamide

Catalog ID
STK629666
SMILES Oc1ccc(cc1)C(=O)NN1C(=S)S/C(=C/c2ccc3c(c2)cccn3)/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 C20H13N3O3S2 MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H13N3O3S2/c24-15-6-4-13(5-7-15)18(25)22-23-19(26)17(28-20(23)27)11-12-3-8-16-14(10-12)2-1-9-21-16/h1-11,24H,(H,22,25)/b17-11+
InChIKey
IEMXFQXMFZPIKB-GZTJUZNOSA-N
Synonyms
951939-49-4
(E)4hydroxyN(4oxo5(quinolin6ylmethylene)2thioxothiazolidin3yl)benzamide
4hydroxyN((5E)4oxo5(quinolin6ylmethylidene)2sulfanylidene13thiazolidin3yl)benzamide
4hydroxyN((5E)4oxo5(quinolin6ylmethylidene)2thioxo13thiazolidin3yl)benzamide
951939494
C1=CC2=C(C=CC(=C2)C=C3C(=O)N(C(=S)S3)NC(=O)C4=CC=C(C=C4)O)N=C1
InChI=1SC20H13N3O3S2c24156413(5715)18(25)222319(26)17(2820(23)27)1112381614(1012)2192116h11124H(H2225)b1711+
MFCD09850861
Oc1ccc(cc1)C(=O)NN1C(=S)SC(=Cc2ccc3c(c2)cccn3)C1=O
ZINC000013688935
ZINC13688935

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Available files

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