5-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]-4-keto-7-methyl-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylic acid methyl ester

SpectraBase Compound ID	5uT4D5m5jHA
InChI	InChI=1S/C25H25N3O5S/c1-13-6-8-15(9-7-13)28-23(31)20-19(21(27-28)24(32)33-5)14(2)34-22(20)26-12-16-17(29)10-25(3,4)11-18(16)30/h6-9,12,26H,10-11H2,1-5H3
InChIKey	ZKRQHTRRORBYOW-UHFFFAOYSA-N Google Search
Mol Weight	479.55 g/mol
Molecular Formula	C25H25N3O5S
Exact Mass	479.151492 g/mol

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SpectraBase Spectrum ID	FIzseNqBbzT
Name	5-[(2,6-diketo-4,4-dimethyl-cyclohexylidene)methylamino]-4-keto-7-methyl-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylic acid methyl ester
Alternate Name(s)	5-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-7-methyl-3-(4-methylphenyl)-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid methyl ester Methyl 5-[(4,4-dimethyl-2,6-dioxo-cyclohexylidene)methylamino]-7-methyl-4-oxo-3-(p-tolyl)thieno[3,4-d]pyridazine-1-carboxylate Methyl 5-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methylamino]-7-methyl-3-(4-methylphenyl)-4-oxothieno[3,4-d]pyridazine-1-carboxylate Methyl 5-[[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]methylamino]-7-methyl-3-(4-methylphenyl)-4-oxidanylidene-thieno[3,4-d]pyridazine-1-carboxylate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C25H25N3O5S
InChI	InChI=1S/C25H25N3O5S/c1-13-6-8-15(9-7-13)28-23(31)20-19(21(27-28)24(32)33-5)14(2)34-22(20)26-12-16-17(29)10-25(3,4)11-18(16)30/h6-9,12,26H,10-11H2,1-5H3
InChIKey	ZKRQHTRRORBYOW-UHFFFAOYSA-N
Molecular Weight	479.551 g/mol
SMILES	N(C=C1C(CC(CC1=O)(C)C)=O)c1c2c(C(C(=O)OC)=NN(C2=O)c2ccc(cc2)C)c(C)s1
SPLASH	splash10-004i-1221900000-019c73cb0b467f49fa63
Source of Spectrum	AJ-43-563-21
Wiley ID	1594025