Vitas-M small molecule compound
2-(2-methoxyethyl)-4-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonyl)isoquinolin-1(2H)-one
Catalog ID
STL243345
SMILES COCCn1cc(C(=O)N2CCN(CC2)C/C=C/c2ccccc2)c2c(c1=O)cccc2
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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 C26H29N3O3 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3/c1-32-19-18-29-20-24(22-11-5-6-12-23(22)25(29)30)26(31)28-16-14-27(15-17-28)13-7-10-21-8-3-2-4-9-21/h2-12,20H,13-19H2,1H3/b10-7+InChIKey
UZQNUQLFGULLQZ-JXMROGBWSA-NSynonyms
1351704-69-2(E)4(4cinnamylpiperazine1carbonyl)2(2methoxyethyl)isoquinolin1(2H)one
1351704692
2(2methoxyethyl)4((4((2E)3phenylprop2en1yl)piperazin1yl)carbonyl)isoquinolin1(2H)one
2(2methoxyethyl)4(4((E)3phenylprop2enyl)piperazine1carbonyl)isoquinolin1one
COCCN1C=C(C2=CC=CC=C2C1=O)C(=O)N3CCN(CC3)CC=CC4=CC=CC=C4
COCCn1cc(C(=O)N2CCN(CC2)CC=Cc2ccccc2)c2c(c1=O)cccc2
InChI=1SC26H29N3O3c1321918292024(2211561223(22)25(29)30)26(31)28161427(151728)13710218324921h21220H1319H21H3b107+
MFCD20535761
ZINC000072400389
ZINC72400389
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