Vitas-M small molecule compound
(2E)-1-[4-(3-chlorophenyl)piperazin-1-yl]-3-(2,3,4-trimethoxyphenyl)prop-2-en-1-one
Catalog ID
STK353645
SMILES COc1c(/C=C/C(=O)N2CCN(CC2)c2cccc(c2)Cl)ccc(c1OC)OC
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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 C22H25ClN2O4 MW 416.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H25ClN2O4/c1-27-19-9-7-16(21(28-2)22(19)29-3)8-10-20(26)25-13-11-24(12-14-25)18-6-4-5-17(23)15-18/h4-10,15H,11-14H2,1-3H3/b10-8+InChIKey
KLQORLVVAVYIBN-CSKARUKUSA-NSynonyms
647031-54-7(2E)1(4(3CHLOROPHENYL)PIPERAZIN1YL)3(234TRIMETHOXYPHENYL)PROP2EN1ONE
(E)1(4(3CHLOROPHENYL)PIPERAZIN1YL)3(234TRIMETHOXYPHENYL)PROP2EN1ONE
1(4(3CHLOROPHENYL)PIPERAZINO)3(234TRIMETHOXYPHENYL)2PROPEN1ONE
647031547
COC1=C(C(=C(C=C1)C=CC(=O)N2CCN(CC2)C3=CC(=CC=C3)Cl)OC)OC
COc1c(C=CC(=O)N2CCN(CC2)c2cccc(c2)Cl)ccc(c1OC)OC
InChI=1SC22H25ClN2O4c127199716(21(282)22(19)293)81020(26)25131124(121425)1864517(23)1518h41015H1114H213H3b108+
MFCD03085665
ZINC000002506081
ZINC02506081
ZINC2506081
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