Vitas-M small molecule compound
3-hydroxy-1-methyl-2-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}methyl)-6-(thiomorpholin-4-ylmethyl)pyridin-4(1H)-one
Catalog ID
STL320442
SMILES Oc1c(=O)cc(n(c1CN1CCN(CC1)C/C=C/c1ccccc1)C)CN1CCSCC1
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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 C25H34N4O2S MW 454.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34N4O2S/c1-26-22(19-29-14-16-32-17-15-29)18-24(30)25(31)23(26)20-28-12-10-27(11-13-28)9-5-8-21-6-3-2-4-7-21/h2-8,18,31H,9-17,19-20H2,1H3/b8-5+InChIKey
OHEFEJUCYKIBFJ-VMPITWQZSA-NSynonyms
1436016-11-3(E)2((4cinnamylpiperazin1yl)methyl)3hydroxy1methyl6(thiomorpholinomethyl)pyridin4(1H)one
1436016113
3hydroxy1methyl2((4((2E)3phenylprop2en1yl)piperazin1yl)methyl)6(thiomorpholin4ylmethyl)pyridin4(1H)one
3hydroxy1methyl2((4((E)3phenylprop2enyl)piperazin1yl)methyl)6(thiomorpholin4ylmethyl)pyridin4one
CN1C(=CC(=O)C(=C1CN2CCN(CC2)CC=CC3=CC=CC=C3)O)CN4CCSCC4
InChI=1SC25H34N4O2Sc12622(1929141632171529)1824(30)25(31)23(26)2028121027(111328)958216324721h281831H9171920H21H3b85+
MFCD23139804
Oc1c(=O)cc(n(c1CN1CCN(CC1)CC=Cc1ccccc1)C)CN1CCSCC1
ZINC000095480814
ZINC95480814
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