Vitas-M small molecule compound

N-(3,4-dimethylphenyl)pyrrolidine-1-carbothioamide

Catalog ID
STK493985
SMILES S=C(N1CCCC1)Nc1ccc(c(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 C13H18N2S MW 234.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H18N2S/c1-10-5-6-12(9-11(10)2)14-13(16)15-7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,14,16)
InChIKey
JCFIHMKMYWINNC-UHFFFAOYSA-N
Synonyms

((34DIMETHYLPHENYL)AMINO)PYRROLIDINYLMETHANE1THIONE
CC1=C(C=C(C=C1)NC(=S)N2CCCC2)C
InChI=1SC13H18N2Sc1105612(911(10)2)1413(16)15734815h569H3478H212H3(H1416)
MFCD03164786
N(34dimethylphenyl)pyrrolidine1carbothioamide
ZINC000006488068
ZINC06488068
ZINC6488068

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Available files

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