Vitas-M small molecule compound

3-{4-[(2-chlorophenyl)carbonyl]piperazin-1-yl}-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Catalog ID
STK721208
SMILES N#Cc1c(nc(c2c1CCCC2)c1ccccc1)N1CCN(CC1)C(=O)c1ccccc1Cl

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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 C27H25ClN4O MW 456.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN4O/c28-24-13-7-6-12-22(24)27(33)32-16-14-31(15-17-32)26-23(18-29)20-10-4-5-11-21(20)25(30-26)19-8-2-1-3-9-19/h1-3,6-9,12-13H,4-5,10-11,14-17H2
InChIKey
DMYUDDFDJAYQAN-UHFFFAOYSA-N
Synonyms
371200-74-7
3(4((2chlorophenyl)carbonyl)piperazin1yl)1phenyl5678tetrahydroisoquinoline4carbonitrile
3(4(2chlorobenzoyl)piperazin1yl)1phenyl5678tetrahydroisoquinoline4carbonitrile
371200747
C1CCC2=C(N=C(C(=C2C1)C#N)N3CCN(CC3)C(=O)C4=CC=CC=C4Cl)C5=CC=CC=C5
InChI=1SC27H25ClN4Oc282413761222(24)27(33)32161431(151732)2623(1829)2010451121(20)25(3026)198213919h13691213H4510111417H2
MFCD01564397
ZINC000020827679
ZINC20827679

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Available files

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