Vitas-M small molecule compound
4-[2-({(E)-[1-(4-nitrophenyl)-5-oxo-3-propyl-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}amino)ethyl]-N-phenylpiperazine-1-carbothioamide
Catalog ID
STL070004
SMILES CCCC1=NN(C(=O)/C/1=C/NCCN1CCN(CC1)C(=S)Nc1ccccc1)c1ccc(cc1)[N+](=O)[O-]
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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 C26H31N7O3S MW 521.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H31N7O3S/c1-2-6-24-23(25(34)32(29-24)21-9-11-22(12-10-21)33(35)36)19-27-13-14-30-15-17-31(18-16-30)26(37)28-20-7-4-3-5-8-20/h3-5,7-12,19,27H,2,6,13-18H2,1H3,(H,28,37)/b23-19+InChIKey
RNEVIOFUHSLUKR-FCDQGJHFSA-NSynonyms
(E)4(2(((1(4nitrophenyl)5oxo3propyl1Hpyrazol4(5H)ylidene)methyl)amino)ethyl)Nphenylpiperazine1carbothioamide
4(2(((E)(1(4nitrophenyl)5oxo3propyl15dihydro4Hpyrazol4ylidene)methyl)amino)ethyl)Nphenylpiperazine1carbothioamide
4(2(((E)(1(4nitrophenyl)5oxo3propylpyrazol4ylidene)methyl)amino)ethyl)Nphenylpiperazine1carbothioamide
CCCC1=NN(C(=O)C1=CNCCN1CCN(CC1)C(=S)Nc1ccccc1)c1ccc(cc1)(N+)(=O)(O)
CCCC1=NN(C(=O)C1=CNCCN2CCN(CC2)C(=S)NC3=CC=CC=C3)C4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC26H31N7O3Sc1262423(25(34)32(2924)2191122(121021)33(35)36)1927131430151731(181630)26(37)28207435820h357121927H261318H21H3(H2837)b2319+
MFCD01811067
ZINC000100163466
ZINC100163466
Check stock
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