2-chloranyl-4-cyano-N-[(3-hydroxyphenyl)methyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-4-cyano-N-[(3-hydroxyphenyl)methyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Openeye Name: 2-chloro-4-cyano-N-[(3-hydroxyphenyl)methyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide CAS Name: 2-chloro-4-cyano-N-[(3-hydroxyphenyl)methyl]-N-[4-[2-(1-pyrrolidinyl)ethoxy]phenyl]benzenesulfonamide IUPAC Name: 2-chloro-4-cyano-N-[(3-hydroxyphenyl)methyl]-N-[4-(2-pyrrolidin-1-ylethoxy)phenyl]benzenesulfonamide Traditional Name: 2-chloro-4-cyano-N-(3-hydroxybenzyl)-N-[4-(2-pyrrolidinoethoxy)phenyl]benzenesulfonamide Formula: C26H26ClN3O4S MolecularWeight: 512.02034

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCOC2=CC=C(C=C2)N(CC3=CC(=CC=C3)O)S(=O)(=O)C4=C(C=C(C=C4)C#N)Cl

Isomeric SMILES

C1CCN(C1)CCOC2=CC=C(C=C2)N(CC3=CC(=CC=C3)O)S(=O)(=O)C4=C(C=C(C=C4)C#N)Cl

InChI

InChI=1S/C26H26ClN3O4S/c27-25-17-20(18-28)6-11-26(25)35(32,33)30(19-21-4-3-5-23(31)16-21)22-7-9-24(10-8-22)34-15-14-29-12-1-2-13-29/h3-11,16-17,31H,1-2,12-15,19H2