Vitas-M small molecule compound
5-(5-{(E)-[3-(carboxymethyl)-4-oxo-2-thioxo-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-2-chlorobenzoic acid
Catalog ID
STL427715
SMILES OC(=O)CN1C(=S)S/C(=C/c2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)/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 C17H10ClNO6S2 MW 423.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H10ClNO6S2/c18-11-3-1-8(5-10(11)16(23)24)12-4-2-9(25-12)6-13-15(22)19(7-14(20)21)17(26)27-13/h1-6H,7H2,(H,20,21)(H,23,24)/b13-6+InChIKey
UTFKQRYZCLNRNP-AWNIVKPZSA-NSynonyms
5(5((3(CARBOXYMETHYL)4OXO2THIOXO(13THIAZOLIDIN5YLIDENE))METHYL)(2FURYL))2CHLOROBENZOICACID
5(5((E)(3(carboxymethyl)4oxo2sulfanylidene13thiazolidin5ylidene)methyl)furan2yl)2chlorobenzoicacid
5(5((E)(3(carboxymethyl)4oxo2thioxo13thiazolidin5ylidene)methyl)furan2yl)2chlorobenzoicacid
C1=CC(=C(C=C1C2=CC=C(O2)C=C3C(=O)N(C(=S)S3)CC(=O)O)C(=O)O)Cl
InChI=1SC17H10ClNO6S2c1811318(510(11)16(23)24)12429(2512)61315(22)19(714(20)21)17(26)2713h16H7H2(H2021)(H2324)b136+
MFCD02627698
OC(=O)CN1C(=S)SC(=Cc2ccc(o2)c2ccc(c(c2)C(=O)O)Cl)C1=O
ZINC000015011887
ZINC15011887
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