Vitas-M small molecule compound

(2E)-3-[1-(2-chlorobenzyl)-1H-indol-3-yl]-2-[(4-phenylpiperazin-1-yl)carbonyl]prop-2-enenitrile

Catalog ID
STK183135
SMILES N#C/C(=C\c1cn(c2c1cccc2)Cc1ccccc1Cl)/C(=O)N1CCN(CC1)c1ccccc1

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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 C29H25ClN4O MW 481.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25ClN4O/c30-27-12-6-4-8-22(27)20-34-21-24(26-11-5-7-13-28(26)34)18-23(19-31)29(35)33-16-14-32(15-17-33)25-9-2-1-3-10-25/h1-13,18,21H,14-17,20H2/b23-18+
InChIKey
PTVJCIVJWYTLTC-PTGBLXJZSA-N
Synonyms
348577-99-1
(2E)3(1((2CHLOROPHENYL)METHYL)INDOL3YL)2((4PHENYLPIPERAZINYL)CARBONYL)PROP2ENENITRILE
(2E)3(1(2CHLOROBENZYL)1HINDOL3YL)2((4PHENYLPIPERAZIN1YL)CARBONYL)PROP2ENENITRILE
(E)3(1((2CHLOROPHENYL)METHYL)INDOL3YL)2(4PHENYLPIPERAZINE1CARBONYL)PROP2ENENITRILE
(E)3(1(2chlorobenzyl)1Hindol3yl)2(4phenylpiperazine1carbonyl)acrylonitrile
348577991
C1CN(CCN1C2=CC=CC=C2)C(=O)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=CC=C5Cl)C#N
InChI=1SC29H25ClN4Oc30271264822(27)20342124(2611571328(26)34)1823(1931)29(35)33161432(151733)2592131025h1131821H141720H2b2318+
MFCD02314117
N#CC(=Cc1cn(c2c1cccc2)Cc1ccccc1Cl)C(=O)N1CCN(CC1)c1ccccc1
ZINC000002309002
ZINC02309002
ZINC2309002

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Available files

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