ethyl 4-[5-[(3-methyl-6-oxidanylidene-1H-pyridazin-5-yl)methyl]thiophen-2-yl]sulfonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[5-[(3-methyl-6-oxidanylidene-1H-pyridazin-5-yl)methyl]thiophen-2-yl]sulfonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[[5-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]-2-thienyl]sulfonyl]piperazine-1-carboxylate CAS Name: 4-[[5-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]-2-thiophenyl]sulfonyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-[(3-methyl-6-oxo-1H-pyridazin-5-yl)methyl]thiophen-2-yl]sulfonylpiperazine-1-carboxylate Traditional Name: 4-[[5-[(6-keto-3-methyl-1H-pyridazin-5-yl)methyl]-2-thienyl]sulfonyl]piperazine-1-carboxylic acid ethyl ester Formula: C17H22N4O5S2 MolecularWeight: 426.51038

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC3=CC(=NNC3=O)C

Isomeric SMILES

CCOC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=C(S2)CC3=CC(=NNC3=O)C

InChI

InChI=1S/C17H22N4O5S2/c1-3-26-17(23)20-6-8-21(9-7-20)28(24,25)15-5-4-14(27-15)11-13-10-12(2)18-19-16(13)22/h4-5,10H,3,6-9,11H2,1-2H3,(H,19,22)