[4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone

Systemtic Name: [4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Openeye Name: [4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone CAS Name: [4-(6-phenoxy-3-pyridazinyl)-1-piperazinyl]-[4-(1-pyrrolidinylsulfonyl)phenyl]methanone IUPAC Name: [4-(6-phenoxypyridazin-3-yl)piperazin-1-yl]-(4-pyrrolidin-1-ylsulfonylphenyl)methanone Traditional Name: [4-(6-phenoxypyridazin-3-yl)piperazino]-(4-pyrrolidinosulfonylphenyl)methanone Formula: C25H27N5O4S MolecularWeight: 493.57798

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NN=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)N3CCN(CC3)C4=NN=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C25H27N5O4S/c31-25(20-8-10-22(11-9-20)35(32,33)30-14-4-5-15-30)29-18-16-28(17-19-29)23-12-13-24(27-26-23)34-21-6-2-1-3-7-21/h1-3,6-13H,4-5,14-19H2