Vitas-M small molecule compound
methyl 4-[({(2E)-2-[(phenylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazol-6-yl}carbonyl)amino]benzoate
Catalog ID
STK627390
SMILES COC(=O)c1ccc(cc1)NC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)c1ccccc1)/[nH]2
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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 C22H17N3O5S2 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17N3O5S2/c1-30-21(27)14-7-10-16(11-8-14)23-20(26)15-9-12-18-19(13-15)31-22(24-18)25-32(28,29)17-5-3-2-4-6-17/h2-13H,1H3,(H,23,26)(H,24,25)InChIKey
KDAMQKLFUKEUCL-UHFFFAOYSA-NSynonyms
929820-53-1929820531
COC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C4=CC=CC=C4
COC(=O)c1ccc(cc1)NC(=O)c1ccc2c(c1)sc(=NS(=O)(=O)c1ccccc1)(nH)2
InChI=1SC22H17N3O5S2c13021(27)1471016(11814)2320(26)159121819(1315)3122(2418)2532(2829)175324617h213H1H3(H2326)(H2425)
methyl4((((2E)2((phenylsulfonyl)imino)23dihydro13benzothiazol6yl)carbonyl)amino)benzoate
methyl4((2(benzenesulfonamido)13benzothiazole6carbonyl)amino)benzoate
MFCD09793409
ZINC000013571659
ZINC13571659
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