Vitas-M small molecule compound

(2E)-2-[2-(3,4-dimethylphenyl)hydrazinylidene]-3-oxo-3-(pyrrolidin-1-yl)propanethioamide

Catalog ID
STL446367
SMILES NC(=S)/C(=N/Nc1ccc(c(c1)C)C)/C(=O)N1CCCC1

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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 C15H20N4OS MW 304.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N4OS/c1-10-5-6-12(9-11(10)2)17-18-13(14(16)21)15(20)19-7-3-4-8-19/h5-6,9,17H,3-4,7-8H2,1-2H3,(H2,16,21)/b18-13-
InChIKey
ZMKSHKKNQCIEJS-AQTBWJFISA-N
Synonyms

(2E)2((34dimethylphenyl)hydrazinylidene)3oxo3pyrrolidin1ylpropanethioamide
(2E)2(2(34dimethylphenyl)hydrazinylidene)3oxo3(pyrrolidin1yl)propanethioamide
CC1=C(C=C(C=C1)NN=C(C(=S)N)C(=O)N2CCCC2)C
InChI=1SC15H20N4OSc1105612(911(10)2)171813(14(16)21)15(20)19734819h56917H3478H212H3(H21621)b1813
MFCD07755671
NC(=S)C(=NNc1ccc(c(c1)C)C)C(=O)N1CCCC1
ZINC000254429632
ZINC101390346

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Available files

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