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

Systemtic Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methoxy-4-morpholin-4-ylsulfonyl-phenyl)methanimine Openeye Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]-N-(2-methoxy-4-morpholinosulfonyl-phenyl)methanimine CAS Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenyl-4-pyrazolyl]-N-[2-methoxy-4-(4-morpholinylsulfonyl)phenyl]methanimine IUPAC Name: 1-[3-(3,4-dimethoxyphenyl)-1-phenylpyrazol-4-yl]-N-(2-methoxy-4-morpholin-4-ylsulfonylphenyl)methanimine Traditional Name: [3-(3,4-dimethoxyphenyl)-1-phenyl-pyrazol-4-yl]methylene-(2-methoxy-4-morpholinosulfonyl-phenyl)amine Formula: C29H30N4O6S MolecularWeight: 562.6367

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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)N4CCOCC4)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)N4CCOCC4)OC)C5=CC=CC=C5)OC

InChI

InChI=1S/C29H30N4O6S/c1-36-26-12-9-21(17-28(26)38-3)29-22(20-33(31-29)23-7-5-4-6-8-23)19-30-25-11-10-24(18-27(25)37-2)40(34,35)32-13-15-39-16-14-32/h4-12,17-20H,13-16H2,1-3H3