Vitas-M small molecule compound
(2-methoxy-3-methylphenyl){4-[4-nitro-3-(prop-2-en-1-ylamino)phenyl]piperazin-1-yl}methanone
Catalog ID
STK206103
SMILES C=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 C22H26N4O4 MW 410.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4/c1-4-10-23-19-15-17(8-9-20(19)26(28)29)24-11-13-25(14-12-24)22(27)18-7-5-6-16(2)21(18)30-3/h4-9,15,23H,1,10-14H2,2-3H3InChIKey
ACTBMGXVTAAEOS-UHFFFAOYSA-NSynonyms
(2METHOXY3METHYLPHENYL)(4(4NITRO3(PROP2EN1YLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
(2METHOXY3METHYLPHENYL)(4(4NITRO3(PROP2ENYLAMINO)PHENYL)PIPERAZIN1YL)METHANONE
C=CCNc1cc(ccc1(N+)(=O)(O))N1CCN(CC1)C(=O)c1cccc(c1OC)C
CC1=CC=CC(=C1OC)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)(N+)(=O)(O))NCC=C
InChI=1SC22H26N4O4c141023191517(8920(19)26(28)29)24111325(141224)22(27)1875616(2)21(18)303h491523H11014H223H3
MFCD06633677
ZINC000004740985
ZINC04740985
ZINC4740985
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