Vitas-M small molecule compound

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

Catalog ID
STL405104
SMILES S=C(Nc1cc(C)ccc1C)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/c1-11-5-6-12(2)14(9-11)20-17(24)19-8-7-18-16(23)15-10-13(3)22(4)21-15/h5-6,9-10H,7-8H2,1-4H3,(H,18,23)(H2,19,20,24)
InChIKey
UYYULFRKMYLVNW-UHFFFAOYSA-N
Synonyms
1005590-18-0
1005590180
CC1=CC(=C(C=C1)C)NC(=S)NCCNC(=O)C2=NN(C(=C2)C)C
InChI=1SC17H23N5OSc1115612(2)14(911)2017(24)19871816(23)151013(3)22(4)2115h56910H78H214H3(H1823)(H2192024)
MFCD06195497
N(2(((25dimethylphenyl)carbamothioyl)amino)ethyl)15dimethyl1Hpyrazole3carboxamide
N(2((25dimethylphenyl)carbamothioylamino)ethyl)15dimethylpyrazole3carboxamide
ZINC000002740465
ZINC02740465
ZINC2740465

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Available files

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