Vitas-M small molecule compound
3-{4-[(4-methoxyphenyl)carbonyl]piperazin-1-yl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile
Catalog ID
STK830095
SMILES COc1ccc(cc1)C(=O)N1CCN(CC1)c1nc(c2ccccc2)c2c(c1C#N)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 C28H28N4O2 MW 452.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N4O2/c1-34-22-13-11-21(12-14-22)28(33)32-17-15-31(16-18-32)27-25(19-29)23-9-5-6-10-24(23)26(30-27)20-7-3-2-4-8-20/h2-4,7-8,11-14H,5-6,9-10,15-18H2,1H3InChIKey
WKPHJNVLZPRUEE-UHFFFAOYSA-NSynonyms
371931-70-33(4((4methoxyphenyl)carbonyl)piperazin1yl)1phenyl5678tetrahydroisoquinoline4carbonitrile
3(4(4methoxybenzoyl)piperazin1yl)1phenyl5678tetrahydroisoquinoline4carbonitrile
371931703
COC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=C4CCCCC4=C3C#N)C5=CC=CC=C5
InChI=1SC28H28N4O2c13422131121(121422)28(33)32171531(161832)2725(1929)239561024(23)26(3027)207324820h24781114H569101518H21H3
MFCD01561956
ZINC000020827336
ZINC20827336
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