1-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methoxy-4-piperidin-1-ylsulfonyl-phenyl)methanimine

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methoxy-4-piperidin-1-ylsulfonyl-phenyl)methanimine Openeye Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-[2-methoxy-4-(1-piperidylsulfonyl)phenyl]methanimine CAS Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-[2-methoxy-4-(1-piperidinylsulfonyl)phenyl]methanimine IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(2-methoxy-4-piperidin-1-ylsulfonylphenyl)methanimine Traditional Name: [3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene-(2-methoxy-4-piperidinosulfonyl-phenyl)amine Formula: C30H32N4O5S MolecularWeight: 560.66388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2C=NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)OC)C5=CC=CC=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2C=NC3=C(C=C(C=C3)S(=O)(=O)N4CCCCC4)OC)C5=CC=CC=C5)OC

InChI

InChI=1S/C30H32N4O5S/c1-37-27-15-12-22(18-29(27)39-3)30-23(21-34(32-30)24-10-6-4-7-11-24)20-31-26-14-13-25(19-28(26)38-2)40(35,36)33-16-8-5-9-17-33/h4,6-7,10-15,18-21H,5,8-9,16-17H2,1-3H3