Vitas-M small molecule compound

1,1'-cyclohexane-1,4-diylbis[3-(4-methoxyphenyl)(thiourea)]

Catalog ID
STK682347
SMILES COc1ccc(cc1)NC(=S)NC1CCC(CC1)NC(=S)Nc1ccc(cc1)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 C22H28N4O2S2 MW 444.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O2S2/c1-27-19-11-7-17(8-12-19)25-21(29)23-15-3-5-16(6-4-15)24-22(30)26-18-9-13-20(28-2)14-10-18/h7-16H,3-6H2,1-2H3,(H2,23,25,29)(H2,24,26,30)
InChIKey
UJZUGKMLVDIHLH-UHFFFAOYSA-N
Synonyms

1(4METHOXYPHENYL)3(4((4METHOXYPHENYL)CARBAMOTHIOYLAMINO)CYCLOHEXYL)THIOUREA
11cyclohexane14diylbis(3(4methoxyphenyl)(thiourea))
COC1=CC=C(C=C1)NC(=S)NC2CCC(CC2)NC(=S)NC3=CC=C(C=C3)OC
InChI=1SC22H28N4O2S2c1271911717(81219)2521(29)23153516(6415)2422(30)261891320(282)141018h716H36H212H3(H2232529)(H2242630)
MFCD03760448
ZINC000008892129
ZINC08892129
ZINC8892129

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Available files

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