3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[phenyl(pyridin-2-yl)methyl]benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[phenyl(pyridin-2-yl)methyl]benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[phenyl(2-pyridyl)methyl]benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[phenyl(2-pyridinyl)methyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[phenyl(pyridin-2-yl)methyl]benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[phenyl(2-pyridyl)methyl]benzamide Formula: C25H26ClN3O3S MolecularWeight: 484.01024

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4)Cl

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=O)NC(C3=CC=CC=C3)C4=CC=CC=N4)Cl

InChI

InChI=1S/C25H26ClN3O3S/c26-21-14-13-20(18-23(21)33(31,32)29-16-8-1-2-9-17-29)25(30)28-24(19-10-4-3-5-11-19)22-12-6-7-15-27-22/h3-7,10-15,18,24H,1-2,8-9,16-17H2,(H,28,30)