(4E)-1-(2-diethylaminoethyl)-4-[(5-methyl-1-phenyl-pyrazol-4-yl)-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione

Systemtic Name: (4E)-1-(2-diethylaminoethyl)-4-[(5-methyl-1-phenyl-pyrazol-4-yl)-oxidanyl-methylidene]-5-thiophen-2-yl-pyrrolidine-2,3-dione Openeye Name: (4E)-1-(2-diethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenyl-pyrazol-4-yl)methylene]-5-(2-thienyl)pyrrolidine-2,3-dione CAS Name: (4E)-1-(2-diethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenyl-4-pyrazolyl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione IUPAC Name: (4E)-1-(2-diethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenylpyrazol-4-yl)methylidene]-5-thiophen-2-ylpyrrolidine-2,3-dione Traditional Name: (4E)-1-(2-diethylaminoethyl)-4-[hydroxy-(5-methyl-1-phenyl-pyrazol-4-yl)methylene]-5-(2-thienyl)pyrrolidine-2,3-quinone Formula: C25H28N4O3S MolecularWeight: 464.57982

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCN1C(C(=C(C2=C(N(N=C2)C3=CC=CC=C3)C)O)C(=O)C1=O)C4=CC=CS4

Isomeric SMILES

CCN(CC)CCN1C(/C(=C(/C2=C(N(N=C2)C3=CC=CC=C3)C)\O)/C(=O)C1=O)C4=CC=CS4

InChI

InChI=1S/C25H28N4O3S/c1-4-27(5-2)13-14-28-22(20-12-9-15-33-20)21(24(31)25(28)32)23(30)19-16-26-29(17(19)3)18-10-7-6-8-11-18/h6-12,15-16,22,30H,4-5,13-14H2,1-3H3/b23-21+