Vitas-M small molecule compound

methyl 4-[({2-[(4-methylpiperidin-1-yl)carbonyl]phenyl}carbamothioyl)amino]-4-oxobutanoate

Catalog ID
STL069207
SMILES COC(=O)CCC(=O)NC(=S)Nc1ccccc1C(=O)N1CCC(CC1)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 C19H25N3O4S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H25N3O4S/c1-13-9-11-22(12-10-13)18(25)14-5-3-4-6-15(14)20-19(27)21-16(23)7-8-17(24)26-2/h3-6,13H,7-12H2,1-2H3,(H2,20,21,23,27)
InChIKey
WMXKCVBORXMEIJ-UHFFFAOYSA-N
Synonyms
875189-95-0
875189950
CC1CCN(CC1)C(=O)C2=CC=CC=C2NC(=S)NC(=O)CCC(=O)OC
InChI=1SC19H25N3O4Sc11391122(121013)18(25)14534615(14)2019(27)2116(23)7817(24)262h3613H712H212H3(H220212327)
methyl4(((2((4methylpiperidin1yl)carbonyl)phenyl)carbamothioyl)amino)4oxobutanoate
METHYL4((2(4METHYLPIPERIDINE1CARBONYL)PHENYL)CARBAMOTHIOYLAMINO)4OXOBUTANOATE
METHYL4(3(2(4METHYLPIPERIDINE1CARBONYL)PHENYL)THIOUREIDO)4OXOBUTANOATE
MFCD05876534
ZINC000004335396
ZINC04335396
ZINC4335396

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Available files

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