Vitas-M small molecule compound
2-[4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl]-N-(3-hydroxypropyl)-2-oxoacetamide
Catalog ID
STL232215
SMILES OCCCNC(=O)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 C25H29N5O3 MW 447.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N5O3/c26-17-21-19-9-4-5-10-20(19)22(18-7-2-1-3-8-18)28-23(21)29-12-14-30(15-13-29)25(33)24(32)27-11-6-16-31/h1-3,7-8,31H,4-6,9-16H2,(H,27,32)InChIKey
ZWJURUFMKCLXMB-UHFFFAOYSA-NSynonyms
929867-19-62(4(4cyano1phenyl5678tetrahydroisoquinolin3yl)piperazin1yl)N(3hydroxypropyl)2oxoacetamide
929867196
C1CCC2=C(N=C(C(=C2C1)C#N)N3CCN(CC3)C(=O)C(=O)NCCCO)C4=CC=CC=C4
InChI=1SC25H29N5O3c261721199451020(19)22(187213818)2823(21)29121430(151329)25(33)24(32)271161631h137831H46916H2(H2732)
MFCD09844830
ZINC000020646620
ZINC20646620
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