Vitas-M small molecule compound
N-{[3-(1,3-benzothiazol-2-yl)phenyl]carbamothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK355563
SMILES S=C(NC(=O)c1ccc2c(c1)OCCO2)Nc1cccc(c1)c1nc2c(s1)cccc2
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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 C23H17N3O3S2 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O3S2/c27-21(14-8-9-18-19(13-14)29-11-10-28-18)26-23(30)24-16-5-3-4-15(12-16)22-25-17-6-1-2-7-20(17)31-22/h1-9,12-13H,10-11H2,(H2,24,26,27,30)InChIKey
MFLIXNJREHDEMR-UHFFFAOYSA-NSynonyms
C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=CC=CC(=C3)C4=NC5=CC=CC=C5S4
InChI=1SC23H17N3O3S2c2721(14891819(1314)2911102818)2623(30)241653415(1216)222517612720(17)3122h191213H1011H2(H224262730)
MFCD06007143
N((3(13benzothiazol2yl)phenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
ZINC000001065806
ZINC01065806
ZINC1065806
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