3-[4-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-5-ethyl-pyrazol-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(4-butan-2-ylphenyl)sulfonylpiperazin-1-yl]carbonyl-5-ethyl-pyrazol-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[5-ethyl-4-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]pyrazol-1-yl]-1H-pyridazin-6-one CAS Name: 3-[4-[[4-(4-butan-2-ylphenyl)sulfonyl-1-piperazinyl]-oxomethyl]-5-ethyl-1-pyrazolyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(4-butan-2-ylphenyl)sulfonylpiperazine-1-carbonyl]-5-ethylpyrazol-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[5-ethyl-4-[4-(4-sec-butylphenyl)sulfonylpiperazine-1-carbonyl]pyrazol-1-yl]-1H-pyridazin-6-one Formula: C24H30N6O4S MolecularWeight: 498.5978

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)CC

Isomeric SMILES

CCC1=C(C=NN1C2=NNC(=O)C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)C(C)CC

InChI

InChI=1S/C24H30N6O4S/c1-4-17(3)18-6-8-19(9-7-18)35(33,34)29-14-12-28(13-15-29)24(32)20-16-25-30(21(20)5-2)22-10-11-23(31)27-26-22/h6-11,16-17H,4-5,12-15H2,1-3H3,(H,27,31)