Vitas-M small molecule compound

N-1,3-benzodioxol-5-yl-N~2~-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-L-leucinamide

Catalog ID
STK657002
SMILES CC(C[C@@H](C(=O)Nc1ccc2c(c1)OCO2)NC(=O)NC1CCS(=O)(=O)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 C18H25N3O6S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H25N3O6S/c1-11(2)7-14(21-18(23)20-13-5-6-28(24,25)9-13)17(22)19-12-3-4-15-16(8-12)27-10-26-15/h3-4,8,11,13-14H,5-7,9-10H2,1-2H3,(H,19,22)(H2,20,21,23)/t13?,14-/m0/s1
InChIKey
UWZMJZIGMUVBRC-KZUDCZAMSA-N
Synonyms
1212456-08-0
(2S)N(13benzodioxol5yl)2((11dioxothiolan3yl)carbamoylamino)4methylpentanamide
(2S)N(benzo(d)(13)dioxol5yl)2(3(11dioxidotetrahydrothiophen3yl)ureido)4methylpentanamide
1212456080
CC(C(C@@H)(C(=O)Nc1ccc2c(c1)OCO2)NC(=O)NC1CCS(=O)(=O)C1)C
CC(C)CC(C(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)NC3CCS(=O)(=O)C3
InChI=1SC18H25N3O6Sc111(2)714(2118(23)20135628(2425)913)17(22)1912341516(812)27102615h348111314H57910H212H3(H1922)(H2202123)t13?14m0s1
MFCD18167885
N13benzodioxol5ylN~2~((11dioxidotetrahydrothiophen3yl)carbamoyl)Lleucinamide
N13BENZODIOXOL5YLN2((11DIOXIDOTETRAHYDROTHIOPHEN3YL)CARBAMOYL)LLEUCINAMIDE
ZINC000036354827
ZINC000036354828

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Available files

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