Vitas-M small molecule compound

4-[2-({[4-(4-methylphenyl)-2,6-dioxocyclohexylidene]methyl}amino)ethyl]-N-phenylpiperazine-1-carbothioamide

Catalog ID
STK136935
SMILES Cc1ccc(cc1)C1CC(=O)/C(=C/NCCN2CCN(CC2)C(=S)Nc2ccccc2)/C(=O)C1

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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 C27H32N4O2S MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N4O2S/c1-20-7-9-21(10-8-20)22-17-25(32)24(26(33)18-22)19-28-11-12-30-13-15-31(16-14-30)27(34)29-23-5-3-2-4-6-23/h2-10,19,22,28H,11-18H2,1H3,(H,29,34)/b24-19-
InChIKey
AGDZJBVKFAPHDQ-CLCOLTQESA-N
Synonyms

4(2(((4(4methylphenyl)26dioxocyclohexylidene)methyl)amino)ethyl)Nphenylpiperazine1carbothioamide
Cc1ccc(cc1)C1CC(=O)C(=CNCCN2CCN(CC2)C(=S)Nc2ccccc2)C(=O)C1
MFCD02139776
ZINC000100424256

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.