3-[4-[4-(1H-indol-6-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(1H-indol-6-ylsulfonyl)piperazin-1-yl]carbonylphenyl]-1H-pyridazin-6-one Openeye Name: 3-[4-[4-(1H-indol-6-ylsulfonyl)piperazine-1-carbonyl]phenyl]-1H-pyridazin-6-one CAS Name: 3-[4-[[4-(1H-indol-6-ylsulfonyl)-1-piperazinyl]-oxomethyl]phenyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(1H-indol-6-ylsulfonyl)piperazine-1-carbonyl]phenyl]-1H-pyridazin-6-one Traditional Name: 3-[4-[4-(1H-indol-6-ylsulfonyl)piperazine-1-carbonyl]phenyl]-1H-pyridazin-6-one Formula: C23H21N5O4S MolecularWeight: 463.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=NNC(=O)C=C3)S(=O)(=O)C4=CC5=C(C=C4)C=CN5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)C3=NNC(=O)C=C3)S(=O)(=O)C4=CC5=C(C=C4)C=CN5

InChI

InChI=1S/C23H21N5O4S/c29-22-8-7-20(25-26-22)16-1-3-18(4-2-16)23(30)27-11-13-28(14-12-27)33(31,32)19-6-5-17-9-10-24-21(17)15-19/h1-10,15,24H,11-14H2,(H,26,29)