2-[2-(phenylsulfonyl)ethylsulfanyl]-N-[(4-pyridin-2-yloxyphenyl)methyl]pyridine-3-carboxamide

Systemtic Name: 2-[2-(phenylsulfonyl)ethylsulfanyl]-N-[(4-pyridin-2-yloxyphenyl)methyl]pyridine-3-carboxamide Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[[4-(2-pyridyloxy)phenyl]methyl]pyridine-3-carboxamide CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-N-[[4-(2-pyridinyloxy)phenyl]methyl]-3-pyridinecarboxamide IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-N-[(4-pyridin-2-yloxyphenyl)methyl]pyridine-3-carboxamide Traditional Name: 2-(2-besylethylthio)-N-[4-(2-pyridyloxy)benzyl]nicotinamide Formula: C26H23N3O4S2 MolecularWeight: 505.60852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)OC4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)CCSC2=C(C=CC=N2)C(=O)NCC3=CC=C(C=C3)OC4=CC=CC=N4

InChI

InChI=1S/C26H23N3O4S2/c30-25(29-19-20-11-13-21(14-12-20)33-24-10-4-5-15-27-24)23-9-6-16-28-26(23)34-17-18-35(31,32)22-7-2-1-3-8-22/h1-16H,17-19H2,(H,29,30)