Vitas-M small molecule compound
4-({[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl}amino)benzoic acid
Catalog ID
STK189331
SMILES O=C(Nc1ccc(cc1)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 C16H11ClN2O3S2 MW 378.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11ClN2O3S2/c17-10-3-6-13-12(7-10)19-16(24-13)23-8-14(20)18-11-4-1-9(2-5-11)15(21)22/h1-7H,8H2,(H,18,20)(H,21,22)InChIKey
QQCSNHMVZLWUQE-UHFFFAOYSA-NSynonyms
4((((5CHLORO13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOICACID
4((2((5CHLORO13BENZOTHIAZOL2YL)SULFANYL)ACETYL)AMINO)BENZOICACID
C1=CC(=CC=C1C(=O)O)NC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl
InChI=1SC16H11ClN2O3S2c1710361312(710)1916(2413)23814(20)1811419(2511)15(21)22h17H8H2(H1820)(H2122)
MFCD02321446
ZINC000002488768
ZINC2488768
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