Vitas-M small molecule compound

N-[1-(1H-benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-5-(furan-2-yl)-1H-pyrazole-3-carboxamide

Catalog ID
STL411266
SMILES CSCCC(c1nc2c([nH]1)cccc2)NC(=O)c1n[nH]c(c1)c1ccco1

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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 C19H19N5O2S MW 381.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H19N5O2S/c1-27-10-8-14(18-20-12-5-2-3-6-13(12)21-18)22-19(25)16-11-15(23-24-16)17-7-4-9-26-17/h2-7,9,11,14H,8,10H2,1H3,(H,20,21)(H,22,25)(H,23,24)
InChIKey
WJPNJRRWJRGLBY-UHFFFAOYSA-N
Synonyms

(S)N(1(1Hbenzo(d)imidazol2yl)3(methylthio)propyl)3(furan2yl)1Hpyrazole5carboxamide
CSCC(C@@H)(c1nc2c((nH)1)cccc2)NC(=O)c1(nH)nc(c1)c1ccco1
CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=NNC(=C3)C4=CC=CO4
CSCCC(c1nc2c((nH)1)cccc2)NC(=O)c1n(nH)c(c1)c1ccco1
InChI=1SC19H19N5O2Sc12710814(182012523613(12)2118)2219(25)161115(232416)177492617h2791114H810H21H3(H2021)(H2225)(H2324)
MFCD30706628
N(1(1Hbenzimidazol2yl)3(methylsulfanyl)propyl)5(furan2yl)1Hpyrazole3carboxamide
N(1(1Hbenzimidazol2yl)3methylsulfanylpropyl)5(furan2yl)1Hpyrazole3carboxamide
ZINC000028509161
ZINC000028509164

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Available files

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