Vitas-M small molecule compound
1-methyl-N-[6-(2-methylbutan-2-yl)-3-(phenylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1H-pyrazole-5-carboxamide
Catalog ID
STK444420
SMILES CCC(C1CCc2c(C1)sc(c2C(=O)Nc1ccccc1)NC(=O)c1ccnn1C)(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 C25H30N4O2S MW 450.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H30N4O2S/c1-5-25(2,3)16-11-12-18-20(15-16)32-24(28-22(30)19-13-14-26-29(19)4)21(18)23(31)27-17-9-7-6-8-10-17/h6-10,13-14,16H,5,11-12,15H2,1-4H3,(H,27,31)(H,28,30)InChIKey
KPQMJAFLLPQIPL-UHFFFAOYSA-NSynonyms
1methylN(6(2methylbutan2yl)3(phenylcarbamoyl)4567tetrahydro1benzothiophen2yl)1Hpyrazole5carboxamide
2methylN(6(2methylbutan2yl)3(phenylcarbamoyl)4567tetrahydro1benzothiophen2yl)pyrazole3carboxamide
CCC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC=C3)NC(=O)C4=CC=NN4C
InChI=1SC25H30N4O2Sc1525(23)1611121820(1516)3224(2822(30)1913142629(19)4)21(18)23(31)271797681017h610131416H5111215H214H3(H2731)(H2830)
MFCD04055570
ZINC000020563067
ZINC000020563070
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