Vitas-M small molecule compound

4-{[(5,5-dimethyl-3-oxocyclohex-1-en-1-yl)amino]methyl}-N-phenylpiperidine-1-carbothioamide

Catalog ID
STL357460
SMILES O=C1C=C(NCC2CCN(CC2)C(=S)Nc2ccccc2)CC(C1)(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 C21H29N3OS MW 371.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N3OS/c1-21(2)13-18(12-19(25)14-21)22-15-16-8-10-24(11-9-16)20(26)23-17-6-4-3-5-7-17/h3-7,12,16,22H,8-11,13-15H2,1-2H3,(H,23,26)
InChIKey
IARXEOVONHCPPF-UHFFFAOYSA-N
Synonyms
337341-34-1
337341341
4(((55dimethyl3oxocyclohex1en1yl)amino)methyl)Nphenylpiperidine1carbothioamide
4(((55DIMETHYL3OXOCYCLOHEXEN1YL)AMINO)METHYL)NPHENYLPIPERIDINE1CARBOTHIOAMIDE
CC1(CC(=CC(=O)C1)NCC2CCN(CC2)C(=S)NC3=CC=CC=C3)C
InChI=1SC21H29N3OSc121(2)1318(1219(25)1421)22151681024(11916)20(26)23176435717h37121622H8111315H212H3(H2326)
MFCD01811055
ZINC000004786069
ZINC04786069
ZINC4786069

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Available files

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