N-(2-pyrrolidin-1-ylethyl)-3-[3-[(thiophen-3-ylmethylamino)methyl]phenyl]benzenesulfonamide

Systemtic Name: N-(2-pyrrolidin-1-ylethyl)-3-[3-[(thiophen-3-ylmethylamino)methyl]phenyl]benzenesulfonamide Openeye Name: N-(2-pyrrolidin-1-ylethyl)-3-[3-[(3-thienylmethylamino)methyl]phenyl]benzenesulfonamide CAS Name: N-[2-(1-pyrrolidinyl)ethyl]-3-[3-[(3-thiophenylmethylamino)methyl]phenyl]benzenesulfonamide IUPAC Name: N-(2-pyrrolidin-1-ylethyl)-3-[3-[(thiophen-3-ylmethylamino)methyl]phenyl]benzenesulfonamide Traditional Name: N-(2-pyrrolidinoethyl)-3-[3-[(3-thenylamino)methyl]phenyl]benzenesulfonamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCNS(=O)(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)CNCC4=CSC=C4

Isomeric SMILES

C1CCN(C1)CCNS(=O)(=O)C2=CC=CC(=C2)C3=CC(=CC=C3)CNCC4=CSC=C4

InChI

InChI=1S/C24H29N3O2S2/c28-31(29,26-10-13-27-11-1-2-12-27)24-8-4-7-23(16-24)22-6-3-5-20(15-22)17-25-18-21-9-14-30-19-21/h3-9,14-16,19,25-26H,1-2,10-13,17-18H2