2-(3-phenylpropylsulfanyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide

Systemtic Name: 2-(3-phenylpropylsulfanyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(3-phenylpropylsulfanyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-(3-phenylpropylthio)-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-(3-phenylpropylsulfanyl)-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-(3-phenylpropylthio)-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C21H26N2O3S2 MolecularWeight: 418.57274

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCCCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CSCCCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2O3S2/c24-21(17-27-15-7-10-18-8-2-1-3-9-18)22-19-11-6-12-20(16-19)28(25,26)23-13-4-5-14-23/h1-3,6,8-9,11-12,16H,4-5,7,10,13-15,17H2,(H,22,24)