6-[4-[[(2S)-4-[(5-chloranyl-1H-indol-2-yl)sulfonyl]-2-methyl-6-oxidanylidene-piperazin-1-yl]methyl]phenyl]-2-methyl-pyridazin-3-one

Systemtic Name: 6-[4-[[(2S)-4-[(5-chloranyl-1H-indol-2-yl)sulfonyl]-2-methyl-6-oxidanylidene-piperazin-1-yl]methyl]phenyl]-2-methyl-pyridazin-3-one Openeye Name: 6-[4-[[(2S)-4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-methyl-6-oxo-piperazin-1-yl]methyl]phenyl]-2-methyl-pyridazin-3-one CAS Name: 6-[4-[[(2S)-4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-methyl-6-oxo-1-piperazinyl]methyl]phenyl]-2-methyl-3-pyridazinone IUPAC Name: 6-[4-[[(2S)-4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-methyl-6-oxopiperazin-1-yl]methyl]phenyl]-2-methylpyridazin-3-one Traditional Name: 6-[4-[[(6S)-4-[(5-chloro-1H-indol-2-yl)sulfonyl]-2-keto-6-methyl-piperazino]methyl]phenyl]-2-methyl-pyridazin-3-one Formula: C25H24ClN5O4S MolecularWeight: 526.00716

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(=O)N1CC2=CC=C(C=C2)C3=NN(C(=O)C=C3)C)S(=O)(=O)C4=CC5=C(N4)C=CC(=C5)Cl

Isomeric SMILES

C[C@H]1CN(CC(=O)N1CC2=CC=C(C=C2)C3=NN(C(=O)C=C3)C)S(=O)(=O)C4=CC5=C(N4)C=CC(=C5)Cl

InChI

InChI=1S/C25H24ClN5O4S/c1-16-13-30(36(34,35)23-12-19-11-20(26)7-8-21(19)27-23)15-25(33)31(16)14-17-3-5-18(6-4-17)22-9-10-24(32)29(2)28-22/h3-12,16,27H,13-15H2,1-2H3/t16-/m0/s1