Vitas-M small molecule compound
1-methyl-N-{3-[(2-methylphenyl)carbamoyl]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl}-1H-pyrazole-5-carboxamide
Catalog ID
STK444415
SMILES O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccnn1C)Nc1ccccc1C
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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 C22H24N4O2S MW 408.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N4O2S/c1-14-8-6-7-10-16(14)24-21(28)19-15-9-4-3-5-11-18(15)29-22(19)25-20(27)17-12-13-23-26(17)2/h6-8,10,12-13H,3-5,9,11H2,1-2H3,(H,24,28)(H,25,27)InChIKey
QWYLTYISULUKHF-UHFFFAOYSA-NSynonyms
1methylN(3((2methylphenyl)carbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)1Hpyrazole5carboxamide
2methylN(3((2methylphenyl)carbamoyl)5678tetrahydro4Hcyclohepta(b)thiophen2yl)pyrazole3carboxamide
CC1=CC=CC=C1NC(=O)C2=C(SC3=C2CCCCC3)NC(=O)C4=CC=NN4C
InChI=1SC22H24N4O2Sc1148671016(14)2421(28)191594351118(15)2922(19)2520(27)1712132326(17)2h68101213H35911H212H3(H2428)(H2527)
MFCD04055565
ZINC000006789775
ZINC06789775
ZINC6789775
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