Vitas-M small molecule compound

N-[(4-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}phenyl)carbamothioyl]-1-benzofuran-2-carboxamide

Catalog ID
STK345545
SMILES Cc1ccc(cc1)C(=O)N1CCN(CC1)c1ccc(cc1)NC(=S)NC(=O)c1cc2c(o1)cccc2

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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 C28H26N4O3S MW 498.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O3S/c1-19-6-8-20(9-7-19)27(34)32-16-14-31(15-17-32)23-12-10-22(11-13-23)29-28(36)30-26(33)25-18-21-4-2-3-5-24(21)35-25/h2-13,18H,14-17H2,1H3,(H2,29,30,33,36)
InChIKey
FOPVJVVGHHAPJU-UHFFFAOYSA-N
Synonyms
642419-83-8
1(BENZOFURAN2CARBONYL)3(4(4(4METHYLBENZOYL)PIPERAZIN1YL)PHENYL)THIOUREA
642419838
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC=C(C=C3)NC(=S)NC(=O)C4=CC5=CC=CC=C5O4
InChI=1SC28H26N4O3Sc1196820(9719)27(34)32161431(151732)23121022(111323)2928(36)3026(33)251821423524(21)3525h21318H1417H21H3(H229303336)
MFCD03907383
N((4(4((4methylphenyl)carbonyl)piperazin1yl)phenyl)carbamothioyl)1benzofuran2carboxamide
N((4(4(4METHYLBENZOYL)PIPERAZIN1YL)PHENYL)CARBAMOTHIOYL)1BENZOFURAN2CARBOXAMIDE
N(1BENZOFURAN2YLCARBONYL)N(4(4(4METHYLBENZOYL)1PIPERAZINYL)PHENYL)THIOUREA
ZINC000012857461
ZINC12857461

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Available files

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