Vitas-M small molecule compound
N-1,3-benzodioxol-5-yl-N~2~-[(1,1-dioxidotetrahydrothiophen-3-yl)carbamoyl]-L-valinamide
Catalog ID
STK652167
SMILES O=C(N[C@H](C(=O)Nc1ccc2c(c1)OCO2)C(C)C)NC1CCS(=O)(=O)C1
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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 C17H23N3O6S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O6S/c1-10(2)15(20-17(22)19-12-5-6-27(23,24)8-12)16(21)18-11-3-4-13-14(7-11)26-9-25-13/h3-4,7,10,12,15H,5-6,8-9H2,1-2H3,(H,18,21)(H2,19,20,22)/t12?,15-/m0/s1InChIKey
XKMNJAGSQKEPKC-CVRLYYSRSA-NSynonyms
1214630-14-4(2S)N(13benzodioxol5yl)2((11dioxothiolan3yl)carbamoylamino)3methylbutanamide
(2S)N(benzo(d)(13)dioxol5yl)2(3(11dioxidotetrahydrothiophen3yl)ureido)3methylbutanamide
1214630144
CC(C)C(C(=O)NC1=CC2=C(C=C1)OCO2)NC(=O)NC3CCS(=O)(=O)C3
InChI=1SC17H23N3O6Sc110(2)15(2017(22)19125627(2324)812)16(21)1811341314(711)2692513h347101215H5689H212H3(H1821)(H2192022)t12?15m0s1
MFCD18166237
N13benzodioxol5ylN~2~((11dioxidotetrahydrothiophen3yl)carbamoyl)Lvalinamide
N13BENZODIOXOL5YLN2((11DIOXIDOTETRAHYDROTHIOPHEN3YL)CARBAMOYL)LVALINAMIDE
O=C(N(C@H)(C(=O)Nc1ccc2c(c1)OCO2)C(C)C)NC1CCS(=O)(=O)C1
ZINC000036359194
ZINC000036359195
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