4-[[methyl-(4-methylphenyl)sulfonyl-amino]methyl]-N-[(E)-pyridin-3-ylmethylideneamino]benzamide

Systemtic Name: 4-[[methyl-(4-methylphenyl)sulfonyl-amino]methyl]-N-[(E)-pyridin-3-ylmethylideneamino]benzamide Openeye Name: 4-[[methyl(p-tolylsulfonyl)amino]methyl]-N-[(E)-3-pyridylmethyleneamino]benzamide CAS Name: 4-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-N-[(E)-3-pyridinylmethylideneamino]benzamide IUPAC Name: 4-[[methyl-(4-methylphenyl)sulfonylamino]methyl]-N-[(E)-pyridin-3-ylmethylideneamino]benzamide Traditional Name: 4-[[methyl(tosyl)amino]methyl]-N-[(E)-3-pyridylmethyleneamino]benzamide Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)NN=CC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC2=CC=C(C=C2)C(=O)N/N=C/C3=CN=CC=C3

InChI

InChI=1S/C22H22N4O3S/c1-17-5-11-21(12-6-17)30(28,29)26(2)16-18-7-9-20(10-8-18)22(27)25-24-15-19-4-3-13-23-14-19/h3-15H,16H2,1-2H3,(H,25,27)/b24-15+