Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-N~2~-(3,4-dimethylphenyl)-N~2~-(methylsulfonyl)alaninamide
Catalog ID
STL071711
SMILES O=C(C(N(S(=O)(=O)C)c1ccc(c(c1)C)C)C)NCc1ccc2c(c1)OCO2
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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 C20H24N2O5S MW 404.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H24N2O5S/c1-13-5-7-17(9-14(13)2)22(28(4,24)25)15(3)20(23)21-11-16-6-8-18-19(10-16)27-12-26-18/h5-10,15H,11-12H2,1-4H3,(H,21,23)InChIKey
VJDPWCGRUOTRIN-UHFFFAOYSA-NSynonyms
CC1=C(C=C(C=C1)N(C(C)C(=O)NCC2=CC3=C(C=C2)OCO3)S(=O)(=O)C)C
InChI=1SC20H24N2O5Sc1135717(914(13)2)22(28(424)25)15(3)20(23)211116681819(1016)27122618h51015H1112H214H3(H2123)
MFCD07393384
N(13BENZODIOXOL5YLMETHYL)2(34DIMETHYLNMETHYLSULFONYLANILINO)PROPANAMIDE
N(13benzodioxol5ylmethyl)N~2~(34dimethylphenyl)N~2~(methylsulfonyl)alaninamide
N(13BENZODIOXOL5YLMETHYL)N2(34DIMETHYLPHENYL)N2(METHYLSULFONYL)ALANINAMIDE
ZINC000005002200
ZINC000005002201
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