Vitas-M small molecule compound

N-({4-[(furan-2-ylcarbonyl)amino]-3-methoxyphenyl}carbamothioyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Catalog ID
STK234330
SMILES COc1cc(ccc1NC(=O)c1ccco1)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 C22H19N3O6S MW 453.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N3O6S/c1-28-18-12-14(5-6-15(18)24-21(27)17-3-2-8-29-17)23-22(32)25-20(26)13-4-7-16-19(11-13)31-10-9-30-16/h2-8,11-12H,9-10H2,1H3,(H,24,27)(H2,23,25,26,32)
InChIKey
INFFIHGMRQCFRZ-UHFFFAOYSA-N
Synonyms

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC3=C(C=C2)OCCO3)NC(=O)C4=CC=CO4
InChI=1SC22H19N3O6Sc128181214(5615(18)2421(27)173282917)2322(32)2520(26)13471619(1113)311093016h281112H910H21H3(H2427)(H223252632)
MFCD03926098
N((4((furan2ylcarbonyl)amino)3methoxyphenyl)carbamothioyl)23dihydro14benzodioxine6carboxamide
N((4(FURAN2CARBONYLAMINO)3METHOXYPHENYL)CARBAMOTHIOYL)23DIHYDRO14BENZODIOXINE6CARBOXAMIDE
N(4((((23DIHYDRO14BENZODIOXIN6YLCARBONYL)AMINO)CARBOTHIOYL)AMINO)2METHOXYPHENYL)2FURAMIDE
ZINC000000665036
ZINC00665036
ZINC665036

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.