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6-(2-Ethoxycarbonylvinyl)-5-[(4-methoxyphenylamino)piperidin-1-yl-methyleneamino]-3,4-diphenylthieno[2,3-c]pyridazine
SpectraBase Compound ID ykRTHmYiSp
InChI InChI=1S/C36H35N5O3S/c1-3-44-30(42)22-21-29-34(38-36(41-23-11-6-12-24-41)37-27-17-19-28(43-2)20-18-27)32-31(25-13-7-4-8-14-25)33(39-40-35(32)45-29)26-15-9-5-10-16-26/h4-5,7-10,13-22H,3,6,11-12,23-24H2,1-2H3,(H,37,38)/b22-21-
InChIKey QIULFKDJOHIMKZ-DQRAZIAOSA-N
Mol Weight 617.8 g/mol
Molecular Formula C36H35N5O3S
Exact Mass 617.246061 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KKrc6IHp34F
Name 6-(2-Ethoxycarbonylvinyl)-5-[(4-methoxyphenylamino)piperidin-1-yl-methyleneamino]-3,4-diphenylthieno[2,3-c]pyridazine
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Formula C36H35N5O3S
InChI InChI=1S/C36H35N5O3S/c1-3-44-30(42)22-21-29-34(38-36(41-23-11-6-12-24-41)37-27-17-19-28(43-2)20-18-27)32-31(25-13-7-4-8-14-25)33(39-40-35(32)45-29)26-15-9-5-10-16-26/h4-5,7-10,13-22H,3,6,11-12,23-24H2,1-2H3,(H,37,38)/b22-21-
InChIKey QIULFKDJOHIMKZ-DQRAZIAOSA-N
Molecular Weight 617.768 g/mol
SMILES N(\C(=N/c1c2c(sc1\C=C/C(=O)OCC)nnc(c2-c1ccccc1)-c1ccccc1)N1CCCCC1)c1ccc(cc1)OC
SPLASH splash10-001i-4020093000-f7aa3478cfad34a00964
Source of Spectrum F-54-8113-5
Synonyms Ethyl (2Z)-3-(5-{[(E)-(4-methoxyanilino)(1-piperidinyl)methylidene]amino}-3,4-diphenylthieno[2,3-c]pyridazin-6-yl)-2-propenoate
Wiley ID 807851