Vitas-M small molecule compound
N-{[3-chloro-4-(2-oxo-2H-chromen-3-yl)phenyl]carbamothioyl}-2,3-dihydro-1,4-benzodioxine-6-carboxamide
Catalog ID
STK355406
SMILES S=C(NC(=O)c1ccc2c(c1)OCCO2)Nc1ccc(c(c1)Cl)c1cc2ccccc2oc1=O
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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 C25H17ClN2O5S MW 492.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17ClN2O5S/c26-19-13-16(6-7-17(19)18-11-14-3-1-2-4-20(14)33-24(18)30)27-25(34)28-23(29)15-5-8-21-22(12-15)32-10-9-31-21/h1-8,11-13H,9-10H2,(H2,27,28,29,34)InChIKey
OUJKFEQPZCPPFT-UHFFFAOYSA-NSynonyms
C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=CC(=C(C=C3)C4=CC5=CC=CC=C5OC4=O)Cl
InChI=1SC25H17ClN2O5Sc26191316(6717(19)181114312420(14)3324(18)30)2725(34)2823(29)15582122(1215)321093121h181113H910H2(H227282934)
MFCD05832351
N((3chloro4(2oxo2Hchromen3yl)phenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
N((3CHLORO4(2OXOCHROMEN3YL)PHENYL)CARBAMOTHIOYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
ZINC000001057672
ZINC01057672
ZINC1057672
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