N-[3-[(3-cyanophenyl)methoxy]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-[(3-cyanophenyl)methoxy]phenyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(3-cyanobenzyl)oxyphenyl]-4-pyrrolidinosulfonyl-benzamide Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)OCC4=CC=CC(=C4)C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=CC(=CC=C3)OCC4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H23N3O4S/c26-17-19-5-3-6-20(15-19)18-32-23-8-4-7-22(16-23)27-25(29)21-9-11-24(12-10-21)33(30,31)28-13-1-2-14-28/h3-12,15-16H,1-2,13-14,18H2,(H,27,29)