Vitas-M small molecule compound

2-methoxy-3-methyl-N-{[4-(4-methylpiperidin-1-yl)phenyl]carbamothioyl}benzamide

Catalog ID
STK254274
SMILES COc1c(C)cccc1C(=O)NC(=S)Nc1ccc(cc1)N1CCC(CC1)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 C22H27N3O2S MW 397.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N3O2S/c1-15-11-13-25(14-12-15)18-9-7-17(8-10-18)23-22(28)24-21(26)19-6-4-5-16(2)20(19)27-3/h4-10,15H,11-14H2,1-3H3,(H2,23,24,26,28)
InChIKey
KNDZNEZBIPHKOL-UHFFFAOYSA-N
Synonyms

(2METHOXY3METHYLPHENYL)N(((4(4METHYLPIPERIDYL)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
2methoxy3methylN((4(4methylpiperidin1yl)phenyl)carbamothioyl)benzamide
CC1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)C3=C(C(=CC=C3)C)OC
InChI=1SC22H27N3O2Sc115111325(141215)189717(81018)2322(28)2421(26)1964516(2)20(19)273h41015H1114H213H3(H223242628)
MFCD03849197
ZINC000004123053
ZINC04123053
ZINC4123053

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Available files

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