Vitas-M small molecule compound
N-[3,5-dimethyl-1-(2-methylbenzyl)-1H-pyrazol-4-yl]azepane-1-carbothioamide
Catalog ID
STK309803
SMILES S=C(N1CCCCCC1)Nc1c(C)nn(c1C)Cc1ccccc1C
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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 C20H28N4S MW 356.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N4S/c1-15-10-6-7-11-18(15)14-24-17(3)19(16(2)22-24)21-20(25)23-12-8-4-5-9-13-23/h6-7,10-11H,4-5,8-9,12-14H2,1-3H3,(H,21,25)InChIKey
XCXBPJCDIWJNSA-UHFFFAOYSA-NSynonyms
1005606-71-21005606712
CC1=CC=CC=C1CN2C(=C(C(=N2)C)NC(=S)N3CCCCCC3)C
InChI=1SC20H28N4Sc11510671118(15)142417(3)19(16(2)2224)2120(25)231284591323h671011H45891214H213H3(H2125)
MFCD04133965
N(35DIMETHYL1((2METHYLPHENYL)METHYL)PYRAZOL4YL)AZEPANE1CARBOTHIOAMIDE
N(35dimethyl1(2methylbenzyl)1Hpyrazol4yl)azepane1carbothioamide
ZINC000002803087
ZINC02803087
ZINC2803087
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