Vitas-M small molecule compound
N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(1-methyl-1H-pyrazol-4-yl)methyl]-3-nitrobenzenesulfonamide
Catalog ID
STL403909
SMILES COc1cc(CCN(S(=O)(=O)c2cccc(c2)[N+](=O)[O-])Cc2cnn(c2)C)ccc1OC
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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 C21H24N4O6S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O6S/c1-23-14-17(13-22-23)15-24(10-9-16-7-8-20(30-2)21(11-16)31-3)32(28,29)19-6-4-5-18(12-19)25(26)27/h4-8,11-14H,9-10,15H2,1-3H3InChIKey
DSHRPBCDYBAGMP-UHFFFAOYSA-NSynonyms
1006991-35-01006991350
CN1C=C(C=N1)CN(CCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C3=CC=CC(=C3)(N+)(=O)(O)
COc1cc(CCN(S(=O)(=O)c2cccc(c2)(N+)(=O)(O))Cc2cnn(c2)C)ccc1OC
InChI=1SC21H24N4O6Sc1231417(132223)1524(109167820(302)21(1116)313)32(2829)1964518(1219)25(26)27h481114H91015H213H3
MFCD08558894
N(2(34dimethoxyphenyl)ethyl)N((1methyl1Hpyrazol4yl)methyl)3nitrobenzenesulfonamide
N(2(34dimethoxyphenyl)ethyl)N((1methylpyrazol4yl)methyl)3nitrobenzenesulfonamide
ZINC000020602073
ZINC20602073
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