Vitas-M small molecule compound

N-[2-(3,4-dimethoxyphenyl)ethyl]-N~2~-(2-methoxy-5-nitrophenyl)-N~2~-(methylsulfonyl)glycinamide

Catalog ID
STL101630
SMILES COc1cc(CCNC(=O)CN(S(=O)(=O)C)c2cc(ccc2OC)[N+](=O)[O-])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 C20H25N3O8S MW 467.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25N3O8S/c1-29-17-8-6-15(23(25)26)12-16(17)22(32(4,27)28)13-20(24)21-10-9-14-5-7-18(30-2)19(11-14)31-3/h5-8,11-12H,9-10,13H2,1-4H3,(H,21,24)
InChIKey
JRNTULROVQPBNB-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)(N+)(=O)(O))N(CC(=O)NCCC2=CC(=C(C=C2)OC)OC)S(=O)(=O)C
COc1cc(CCNC(=O)CN(S(=O)(=O)C)c2cc(ccc2OC)(N+)(=O)(O))ccc1OC
InChI=1SC20H25N3O8Sc129178615(23(25)26)1216(17)22(32(427)28)1320(24)21109145718(302)19(1114)313h581112H91013H214H3(H2124)
MFCD06626063
N(2(34DIMETHOXYPHENYL)ETHYL)2(2METHOXYNMETHYLSULFONYL5NITROANILINO)ACETAMIDE
N(2(34dimethoxyphenyl)ethyl)N~2~(2methoxy5nitrophenyl)N~2~(methylsulfonyl)glycinamide
N(2(34DIMETHOXYPHENYL)ETHYL)N2(2METHOXY5NITROPHENYL)N2(METHYLSULFONYL)GLYCINAMIDE
N1(2(34DIMETHOXYPHENYL)ETHYL)N2(2METHOXY5NITROPHENYL)N2(METHYLSULFONYL)GLYCINAMIDE
ZINC000002875921
ZINC02875921
ZINC2875921

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Available files

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