Vitas-M small molecule compound

N-(2-{[(2,3-dimethylphenyl)carbamothioyl]amino}ethyl)-1,5-dimethyl-1H-pyrazole-3-carboxamide

Catalog ID
STL405161
SMILES S=C(Nc1cccc(c1C)C)NCCNC(=O)c1cc(n(n1)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 C17H23N5OS MW 345.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N5OS/c1-11-6-5-7-14(13(11)3)20-17(24)19-9-8-18-16(23)15-10-12(2)22(4)21-15/h5-7,10H,8-9H2,1-4H3,(H,18,23)(H2,19,20,24)
InChIKey
QMSNPUCNHMKJEO-UHFFFAOYSA-N
Synonyms
1005638-77-6
1005638776
CC1=C(C(=CC=C1)NC(=S)NCCNC(=O)C2=NN(C(=C2)C)C)C
InChI=1SC17H23N5OSc11165714(13(11)3)2017(24)19981816(23)151012(2)22(4)2115h5710H89H214H3(H1823)(H2192024)
MFCD06195765
N(2(((23dimethylphenyl)carbamothioyl)amino)ethyl)15dimethyl1Hpyrazole3carboxamide
N(2((23dimethylphenyl)carbamothioylamino)ethyl)15dimethylpyrazole3carboxamide
ZINC000002741206
ZINC02741206
ZINC2741206

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Available files

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