N-[[3-(dimethylamino)phenyl]-(4-methylsulfonylphenyl)methyl]-2-phenylazanyl-pyridine-3-carboxamide

Systemtic Name: N-[[3-(dimethylamino)phenyl]-(4-methylsulfonylphenyl)methyl]-2-phenylazanyl-pyridine-3-carboxamide Openeye Name: 2-anilino-N-[[3-(dimethylamino)phenyl]-(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide CAS Name: 2-anilino-N-[[3-(dimethylamino)phenyl]-(4-methylsulfonylphenyl)methyl]-3-pyridinecarboxamide IUPAC Name: 2-anilino-N-[[3-(dimethylamino)phenyl]-(4-methylsulfonylphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-anilino-N-[[3-(dimethylamino)phenyl]-(4-mesylphenyl)methyl]nicotinamide Formula: C28H28N4O3S MolecularWeight: 500.61192

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=CC(=C1)C(C2=CC=C(C=C2)S(=O)(=O)C)NC(=O)C3=C(N=CC=C3)NC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC=CC(=C1)C(C2=CC=C(C=C2)S(=O)(=O)C)NC(=O)C3=C(N=CC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C28H28N4O3S/c1-32(2)23-12-7-9-21(19-23)26(20-14-16-24(17-15-20)36(3,34)35)31-28(33)25-13-8-18-29-27(25)30-22-10-5-4-6-11-22/h4-19,26H,1-3H3,(H,29,30)(H,31,33)