Vitas-M small molecule compound

4-[(4-tert-butylphenyl)sulfonyl]-N-(2,5-dimethylphenyl)piperazine-1-carbothioamide

Catalog ID
STK472790
SMILES Cc1ccc(c(c1)NC(=S)N1CCN(CC1)S(=O)(=O)c1ccc(cc1)C(C)(C)C)C

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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 C23H31N3O2S2 MW 445.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O2S2/c1-17-6-7-18(2)21(16-17)24-22(29)25-12-14-26(15-13-25)30(27,28)20-10-8-19(9-11-20)23(3,4)5/h6-11,16H,12-15H2,1-5H3,(H,24,29)
InChIKey
VAKDTCYFEQIFER-UHFFFAOYSA-N
Synonyms

1((4(TERTBUTYL)PHENYL)SULFONYL)4(((25DIMETHYLPHENYL)AMINO)THIOXOMETHYL)PIPERAZINE
4((4tertbutylphenyl)sulfonyl)N(25dimethylphenyl)piperazine1carbothioamide
4(4tertbutylphenyl)sulfonylN(25dimethylphenyl)piperazine1carbothioamide
CC1=CC(=C(C=C1)C)NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC23H31N3O2S2c1176718(2)21(1617)2422(29)25121426(151325)30(2728)2010819(91120)23(34)5h61116H1215H215H3(H2429)
MFCD07080165
ZINC000019644009
ZINC19644009

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Available files

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