N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]methyl]-N-propan-2-yl-methanesulfonamide

Systemtic Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxidanylidene-pyridin-3-yl]methyl]-N-propan-2-yl-methanesulfonamide Openeye Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridyl]methyl]-N-isopropyl-methanesulfonamide CAS Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxo-3-pyridinyl]methyl]-N-propan-2-ylmethanesulfonamide IUPAC Name: N-[[6-butyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2-oxopyridin-3-yl]methyl]-N-propan-2-ylmethanesulfonamide Traditional Name: N-[[6-butyl-1-[4-(2-cyanophenyl)benzyl]-2-keto-3-pyridyl]methyl]-N-isopropyl-methanesulfonamide Formula: C28H33N3O3S MolecularWeight: 491.64492

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CN(C(C)C)S(=O)(=O)C

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CN(C(C)C)S(=O)(=O)C

InChI

InChI=1S/C28H33N3O3S/c1-5-6-10-26-17-16-25(20-31(21(2)3)35(4,33)34)28(32)30(26)19-22-12-14-23(15-13-22)27-11-8-7-9-24(27)18-29/h7-9,11-17,21H,5-6,10,19-20H2,1-4H3