Vitas-M small molecule compound
{4-[3-(ethylamino)-4-nitrophenyl]piperazin-1-yl}(2-methoxy-3-methylphenyl)methanone
Catalog ID
STK198669
SMILES CCNc1cc(ccc1[N+](=O)[O-])N1CCN(CC1)C(=O)c1cccc(c1OC)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 C21H26N4O4 MW 398.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O4/c1-4-22-18-14-16(8-9-19(18)25(27)28)23-10-12-24(13-11-23)21(26)17-7-5-6-15(2)20(17)29-3/h5-9,14,22H,4,10-13H2,1-3H3InChIKey
ZNPQVWPVAFBSME-UHFFFAOYSA-NSynonyms
(4(3(ETHYLAMINO)4NITROPHENYL)PIPERAZIN1YL)(2METHOXY3METHYLPHENYL)METHANONE
CCNC1=C(C=CC(=C1)N2CCN(CC2)C(=O)C3=C(C(=CC=C3)C)OC)(N+)(=O)(O)
CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccc(c1OC)C
InChI=1SC21H26N4O4c1422181416(8919(18)25(27)28)23101224(131123)21(26)1775615(2)20(17)293h591422H41013H213H3
MFCD05826440
ZINC000004739213
ZINC04739213
ZINC4739213
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