Vitas-M small molecule compound
1-methyl-N-(4-{(1Z)-1-[2-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylcarbonyl)hydrazinylidene]ethyl}phenyl)-1H-pyrazole-5-carboxamide
Catalog ID
STK429711
SMILES C/C(=N/NC(=O)c1csc2c1CCCC2)/c1ccc(cc1)NC(=O)c1ccnn1C
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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 C22H23N5O2S MW 421.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N5O2S/c1-14(25-26-21(28)18-13-30-20-6-4-3-5-17(18)20)15-7-9-16(10-8-15)24-22(29)19-11-12-23-27(19)2/h7-13H,3-6H2,1-2H3,(H,24,29)(H,26,28)/b25-14-InChIKey
MLCHHSIPCYBDGY-QFEZKATASA-NSynonyms
1methylN(4((1Z)1(2(4567tetrahydro1benzothiophen3ylcarbonyl)hydrazinylidene)ethyl)phenyl)1Hpyrazole5carboxamide
2methylN(4((Z)CmethylN(4567tetrahydro1benzothiophene3carbonylamino)carbonimidoyl)phenyl)pyrazole3carboxamide
CC(=NNC(=O)C1=CSC2=C1CCCC2)C3=CC=C(C=C3)NC(=O)C4=CC=NN4C
CC(=NNC(=O)c1csc2c1CCCC2)c1ccc(cc1)NC(=O)c1ccnn1C
InChI=1SC22H23N5O2Sc114(252621(28)18133020643517(18)20)157916(10815)2422(29)1911122327(19)2h713H36H212H3(H2429)(H2628)b2514
MFCD03234146
ZINC000005826726
ZINC20159542
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