Vitas-M small molecule compound

N-(bicyclo[2.2.1]hept-2-yl)-4-(2,5-dimethylphenyl)piperazine-1-carbothioamide

Catalog ID
STK448140
SMILES Cc1ccc(c(c1)N1CCN(CC1)C(=S)NC1CC2CC1CC2)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 C20H29N3S MW 343.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H29N3S/c1-14-3-4-15(2)19(11-14)22-7-9-23(10-8-22)20(24)21-18-13-16-5-6-17(18)12-16/h3-4,11,16-18H,5-10,12-13H2,1-2H3,(H,21,24)
InChIKey
OKSICFDWTNUEKX-UHFFFAOYSA-N
Synonyms

(BICYCLO(221)HEPT2YLAMINO)(4(25DIMETHYLPHENYL)PIPERAZINYL)METHANE1THIONE
CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=S)NC3CC4CCC3C4
InChI=1SC20H29N3Sc1143415(2)19(1114)227923(10822)20(24)211813165617(18)1216h34111618H5101213H212H3(H2124)
MFCD04138198
N(3bicyclo(221)heptanyl)4(25dimethylphenyl)piperazine1carbothioamide
N(bicyclo(221)hept2yl)4(25dimethylphenyl)piperazine1carbothioamide
ZINC000102605551
ZINC000102605554

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Available files

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