Vitas-M small molecule compound

4-(diphenylmethyl)-N-(3,4,5-trimethoxyphenyl)piperazine-1-carbothioamide

Catalog ID
STK741896
SMILES COc1cc(NC(=S)N2CCN(CC2)C(c2ccccc2)c2ccccc2)cc(c1OC)OC

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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 C27H31N3O3S MW 477.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O3S/c1-31-23-18-22(19-24(32-2)26(23)33-3)28-27(34)30-16-14-29(15-17-30)25(20-10-6-4-7-11-20)21-12-8-5-9-13-21/h4-13,18-19,25H,14-17H2,1-3H3,(H,28,34)
InChIKey
RJLFKTAQMNIYHR-UHFFFAOYSA-N
Synonyms
879567-15-4
4(diphenylmethyl)N(345trimethoxyphenyl)piperazine1carbothioamide
4benzhydrylN(345trimethoxyphenyl)piperazine1carbothioamide
879567154
COC1=CC(=CC(=C1OC)OC)NC(=S)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4
InChI=1SC27H31N3O3Sc131231822(1924(322)26(23)333)2827(34)30161429(151730)25(20106471120)21128591321h413181925H1417H213H3(H2834)
MFCD07084354
ZINC000020228330
ZINC20228330

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Available files

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