Vitas-M small molecule compound

N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]pyrrolidine-1-carbothioamide

Catalog ID
STL398808
SMILES S=C(N1CCCC1)Nc1c(C)nn(c1C)Cc1ccccc1C

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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 C18H24N4S MW 328.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H24N4S/c1-13-8-4-5-9-16(13)12-22-15(3)17(14(2)20-22)19-18(23)21-10-6-7-11-21/h4-5,8-9H,6-7,10-12H2,1-3H3,(H,19,23)
InChIKey
BVNWUWDRCVYOAQ-UHFFFAOYSA-N
Synonyms
1005584-86-0
1005584860
CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=S)N3CCCC3)C
InChI=1SC18H24N4Sc113845916(13)122215(3)17(14(2)2022)1918(23)2110671121h4589H671012H213H3(H1923)
MFCD04133888
N(35DIMETHYL1((2METHYLPHENYL)METHYL)PYRAZOL4YL)PYRROLIDINE1CARBOTHIOAMIDE
N(35DIMETHYL1(2METHYLBENZYL)1HPYRAZOL4YL)PYRROLIDINE1CARBOTHIOAMIDE
ZINC000002802989
ZINC02802989
ZINC2802989

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Available files

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