1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(4-piperidin-1-ylsulfonylphenyl)methanimine

Systemtic Name: 1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-(4-piperidin-1-ylsulfonylphenyl)methanimine Openeye Name: 1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]-N-[4-(1-piperidylsulfonyl)phenyl]methanimine CAS Name: 1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]-N-[4-(1-piperidinylsulfonyl)phenyl]methanimine IUPAC Name: 1-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]-N-(4-piperidin-1-ylsulfonylphenyl)methanimine Traditional Name: [3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylene-(4-piperidinosulfonylphenyl)amine Formula: C29H28N4O4S MolecularWeight: 528.62202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CN(N=C3C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)N=CC3=CN(N=C3C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6

InChI

InChI=1S/C29H28N4O4S/c34-38(35,32-15-5-2-6-16-32)26-12-10-24(11-13-26)30-20-23-21-33(25-7-3-1-4-8-25)31-29(23)22-9-14-27-28(19-22)37-18-17-36-27/h1,3-4,7-14,19-21H,2,5-6,15-18H2