Vitas-M small molecule compound

2-hydroxy-5-({3-[(5Z)-4-oxo-5-(thiophen-2-ylmethylidene)-2-thioxo-1,3-thiazolidin-3-yl]propanoyl}amino)benzoic acid

Catalog ID
STK533645
SMILES O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)S/C(=C\c2cccs2)/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 C18H14N2O5S3 MW 434.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O5S3/c21-13-4-3-10(8-12(13)17(24)25)19-15(22)5-6-20-16(23)14(28-18(20)26)9-11-2-1-7-27-11/h1-4,7-9,21H,5-6H2,(H,19,22)(H,24,25)/b14-9-
InChIKey
LBLMAQXNQCNDRL-ZROIWOOFSA-N
Synonyms

(Z)2hydroxy5(3(4oxo5(thiophen2ylmethylene)2thioxothiazolidin3yl)propanamido)benzoicacid
2hydroxy5((3((5Z)4oxo5(thiophen2ylmethylidene)2thioxo13thiazolidin3yl)propanoyl)amino)benzoicacid
2HYDROXY5(3((5Z)4OXO2SULFANYLIDENE5(THIOPHEN2YLMETHYLIDENE)13THIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
2HYDROXY5(3((5Z)4OXO5(2THIENYLMETHYLENE)2THIOXOTHIAZOLIDIN3YL)PROPANOYLAMINO)BENZOICACID
2HYDROXY5(3(4OXO5(1THIOPHEN2YLMETH(Z)YLIDENE)2THIOXOTHIAZOLIDIN3YL)PROPIONYLAMINO)BENZOICACID
BENZOICACID2HYDROXY5((1OXO3((5Z)4OXO5(2THIENYLMETHYLENE)2THIOXO3THIAZOLIDINYL)PROPYL)AMINO)
C1=CSC(=C1)C=C2C(=O)N(C(=S)S2)CCC(=O)NC3=CC(=C(C=C3)O)C(=O)O
InChI=1SC18H14N2O5S3c21134310(812(13)17(24)25)1915(22)562016(23)14(2818(20)26)9112172711h147921H56H2(H1922)(H2425)b149
MFCD02226812
O=C(Nc1ccc(c(c1)C(=O)O)O)CCN1C(=S)SC(=Cc2cccs2)C1=O
ZINC000001825644
ZINC1825644

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Available files

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