Vitas-M small molecule compound
2-(1,1-dioxidotetrahydrothiophen-3-yl)-6-({4-[(2E)-3-phenylprop-2-en-1-yl]piperazin-1-yl}carbonyl)-4,5-dihydropyridazin-3(2H)-one
Catalog ID
STL161490
SMILES O=C1CCC(=NN1C1CCS(=O)(=O)C1)C(=O)N1CCN(CC1)C/C=C/c1ccccc1
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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 C22H28N4O4S MW 444.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O4S/c27-21-9-8-20(23-26(21)19-10-16-31(29,30)17-19)22(28)25-14-12-24(13-15-25)11-4-7-18-5-2-1-3-6-18/h1-7,19H,8-17H2/b7-4+InChIKey
AYUSNURLLSIJMS-QPJJXVBHSA-NSynonyms
1282458-32-5(E)6(4cinnamylpiperazine1carbonyl)2(11dioxidotetrahydrothiophen3yl)45dihydropyridazin3(2H)one
1282458325
2(11dioxidotetrahydrothiophen3yl)6((4((2E)3phenylprop2en1yl)piperazin1yl)carbonyl)45dihydropyridazin3(2H)one
2(11dioxothiolan3yl)6(4((E)3phenylprop2enyl)piperazine1carbonyl)45dihydropyridazin3one
C1CS(=O)(=O)CC1N2C(=O)CCC(=N2)C(=O)N3CCN(CC3)CC=CC4=CC=CC=C4
InChI=1SC22H28N4O4Sc27219820(2326(21)19101631(2930)1719)22(28)25141224(131525)1147185213618h1719H817H2b74+
MFCD18797848
O=C1CCC(=NN1C1CCS(=O)(=O)C1)C(=O)N1CCN(CC1)CC=Cc1ccccc1
ZINC000061719161
ZINC000061719162
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