Vitas-M small molecule compound

N-{[4-(4-butanoylpiperazin-1-yl)phenyl]carbamothioyl}-4-tert-butylbenzamide

Catalog ID
STL225148
SMILES CCCC(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1ccc(cc1)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 C26H34N4O2S MW 466.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H34N4O2S/c1-5-6-23(31)30-17-15-29(16-18-30)22-13-11-21(12-14-22)27-25(33)28-24(32)19-7-9-20(10-8-19)26(2,3)4/h7-14H,5-6,15-18H2,1-4H3,(H2,27,28,32,33)
InChIKey
NNDAMWKXORRZNG-UHFFFAOYSA-N
Synonyms

CCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC26H34N4O2Sc15623(31)30171529(161830)22131121(121422)2725(33)2824(32)197920(10819)26(23)4h714H561518H214H3(H227283233)
MFCD04551517
N((4(4butanoylpiperazin1yl)phenyl)carbamothioyl)4tertbutylbenzamide
ZINC000032125372
ZINC32125372

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Available files

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