Vitas-M small molecule compound
ethyl 3-[({(2E)-2-[(methylsulfonyl)imino]-2,3-dihydro-1,3-benzothiazol-6-yl}carbonyl)amino]benzoate
Catalog ID
STK625498
SMILES CCOC(=O)c1cccc(c1)NC(=O)c1ccc2c(c1)s/c(=N/S(=O)(=O)C)/[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 C18H17N3O5S2 MW 419.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17N3O5S2/c1-3-26-17(23)12-5-4-6-13(9-12)19-16(22)11-7-8-14-15(10-11)27-18(20-14)21-28(2,24)25/h4-10H,3H2,1-2H3,(H,19,22)(H,20,21)InChIKey
IPBSPALQZQCWGO-UHFFFAOYSA-NSynonyms
951957-37-2951957372
CCOC(=O)C1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(S3)NS(=O)(=O)C
CCOC(=O)c1cccc(c1)NC(=O)c1ccc2c(c1)sc(=NS(=O)(=O)C)(nH)2
ethyl3((((2E)2((methylsulfonyl)imino)23dihydro13benzothiazol6yl)carbonyl)amino)benzoate
ethyl3((2(methanesulfonamido)13benzothiazole6carbonyl)amino)benzoate
InChI=1SC18H17N3O5S2c132617(23)1254613(912)1916(22)11781415(1011)2718(2014)2128(224)25h410H3H212H3(H1922)(H2021)
MFCD18159111
ZINC000013719993
ZINC13719993
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