Vitas-M small molecule compound

methyl 4-[({4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}carbamothioyl)amino]-4-oxobutanoate

Catalog ID
STK015002
SMILES COC(=O)CCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C

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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 C16H18N4O6S2 MW 426.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N4O6S2/c1-10-9-13(19-26-10)20-28(23,24)12-5-3-11(4-6-12)17-16(27)18-14(21)7-8-15(22)25-2/h3-6,9H,7-8H2,1-2H3,(H,19,20)(H2,17,18,21,27)
InChIKey
AHRYXPGDYBPRAK-UHFFFAOYSA-N
Synonyms
500201-43-4
500201434
CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCC(=O)OC
COC(=O)CCC(=O)NC(=S)Nc1ccc(cc1)S(=O)(=O)Nc1noc(c1)C
InChI=1SC16H18N4O6S2c110913(192610)2028(2324)125311(4612)1716(27)1814(21)7815(22)252h369H78H212H3(H1920)(H217182127)
METHYL4(((4(((5METHYL3ISOXAZOLYL)AMINO)SULFONYL)ANILINO)CARBOTHIOYL)AMINO)4OXOBUTANOATE
METHYL4(((4((5METHYL12OXAZOL3YL)SULFAMOYL)PHENYL)CARBAMOTHIOYL)AMINO)4OXOBUTANOATE
METHYL4((4((5METHYL12OXAZOL3YL)SULFAMOYL)PHENYL)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
METHYL4(3(4(N(5METHYLISOXAZOL3YL)SULFAMOYL)PHENYL)THIOUREIDO)4OXOBUTANOATE
MFCD03586654
STK015002
ZINC000002135587
ZINC2135587

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Available files

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