4-acetamido-N-butylsulfonyl-3-[(4-pyridin-2-ylphenyl)methylamino]benzamide

Systemtic Name: 4-acetamido-N-butylsulfonyl-3-[(4-pyridin-2-ylphenyl)methylamino]benzamide Openeye Name: 4-acetamido-N-butylsulfonyl-3-[[4-(2-pyridyl)phenyl]methylamino]benzamide CAS Name: 4-acetamido-N-butylsulfonyl-3-[[4-(2-pyridinyl)phenyl]methylamino]benzamide IUPAC Name: 4-acetamido-N-butylsulfonyl-3-[(4-pyridin-2-ylphenyl)methylamino]benzamide Traditional Name: 4-acetamido-N-butylsulfonyl-3-[[4-(2-pyridyl)benzyl]amino]benzamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC(=C(C=C1)NC(=O)C)NCC2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC(=C(C=C1)NC(=O)C)NCC2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C25H28N4O4S/c1-3-4-15-34(32,33)29-25(31)21-12-13-23(28-18(2)30)24(16-21)27-17-19-8-10-20(11-9-19)22-7-5-6-14-26-22/h5-14,16,27H,3-4,15,17H2,1-2H3,(H,28,30)(H,29,31)