3-chloranyl-N-phenyl-N-(phenylmethyl)-5-[2-(pyridin-4-ylamino)ethylamino]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-phenyl-N-(phenylmethyl)-5-[2-(pyridin-4-ylamino)ethylamino]benzenesulfonamide Openeye Name: N-benzyl-3-chloro-N-phenyl-5-[2-(4-pyridylamino)ethylamino]benzenesulfonamide CAS Name: 3-chloro-N-phenyl-N-(phenylmethyl)-5-[2-(pyridin-4-ylamino)ethylamino]benzenesulfonamide IUPAC Name: N-benzyl-3-chloro-N-phenyl-5-[2-(pyridin-4-ylamino)ethylamino]benzenesulfonamide Traditional Name: N-benzyl-3-chloro-N-phenyl-5-[2-(4-pyridylamino)ethylamino]benzenesulfonamide Formula: C26H25ClN4O2S MolecularWeight: 493.0203

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)NCCNC4=CC=NC=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CN(C2=CC=CC=C2)S(=O)(=O)C3=CC(=CC(=C3)NCCNC4=CC=NC=C4)Cl

InChI

InChI=1S/C26H25ClN4O2S/c27-22-17-24(30-16-15-29-23-11-13-28-14-12-23)19-26(18-22)34(32,33)31(25-9-5-2-6-10-25)20-21-7-3-1-4-8-21/h1-14,17-19,30H,15-16,20H2,(H,28,29)