Vitas-M small molecule compound
5-({[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)benzene-1,3-dicarboxylic acid
Catalog ID
STK220095
SMILES O=C(Nc1cc(cc(c1)C(=O)O)C(=O)O)CSc1nc2c(s1)ccc(c2)Cl
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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 C17H11ClN2O5S2 MW 422.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H11ClN2O5S2/c18-10-1-2-13-12(6-10)20-17(27-13)26-7-14(21)19-11-4-8(15(22)23)3-9(5-11)16(24)25/h1-6H,7H2,(H,19,21)(H,22,23)(H,24,25)InChIKey
XCAZJRCOBHEYSA-UHFFFAOYSA-NSynonyms
5((((5CHLORO13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZENE13DICARBOXYLICACID
5((2((5chloro13benzothiazol2yl)sulfanyl)acetyl)amino)benzene13dicarboxylicacid
C1=CC2=C(C=C1Cl)N=C(S2)SCC(=O)NC3=CC(=CC(=C3)C(=O)O)C(=O)O
InChI=1SC17H11ClN2O5S2c1810121312(610)2017(2713)26714(21)191148(15(22)23)39(511)16(24)25h16H7H2(H1921)(H2223)(H2425)
MFCD07565441
ZINC000010059980
ZINC10059980
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