Vitas-M small molecule compound
N-[(4-{[(2-chlorophenyl)carbonyl]amino}-3-methoxyphenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK345130
SMILES COc1cc(ccc1NC(=O)c1ccccc1Cl)NC(=S)NC(=O)c1ccc2c(c1)OCCO2
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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 C24H20ClN3O5S MW 497.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20ClN3O5S/c1-31-20-13-15(7-8-18(20)27-23(30)16-4-2-3-5-17(16)25)26-24(34)28-22(29)14-6-9-19-21(12-14)33-11-10-32-19/h2-9,12-13H,10-11H2,1H3,(H,27,30)(H2,26,28,29,34)InChIKey
VURSNXULXIPONT-UHFFFAOYSA-NSynonyms
2CHLORON(4((((23DIHYDRO14BENZODIOXIN6YLCARBONYL)AMINO)CARBOTHIOYL)AMINO)2METHOXYPHENYL)BENZAMIDE
COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)OCCO3)NC(=O)C4=CC=CC=C4Cl
InChI=1SC24H20ClN3O5Sc131201315(7818(20)2723(30)16423517(16)25)2624(34)2822(29)14691921(1214)3311103219h291213H1011H21H3(H2730)(H226282934)
MFCD08125708
N((4(((2chlorophenyl)carbonyl)amino)3methoxyphenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
N((4((2chlorobenzoyl)amino)3methoxyphenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
ZINC000012856419
ZINC12856419
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