3-[(phenylmethyl)-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]propanamide

Systemtic Name: 3-[(phenylmethyl)-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]propanamide Openeye Name: 3-[benzyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonyl-amino]propanamide CAS Name: 3-[(phenylmethyl)-[4-(1-pyrrolidinylsulfonyl)phenyl]sulfonylamino]propanamide IUPAC Name: 3-[benzyl-(4-pyrrolidin-1-ylsulfonylphenyl)sulfonylamino]propanamide Traditional Name: 3-[benzyl-(4-pyrrolidinosulfonylphenyl)sulfonyl-amino]propionamide Formula: C20H25N3O5S2 MolecularWeight: 451.5596

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)S(=O)(=O)N(CCC(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C20H25N3O5S2/c21-20(24)12-15-23(16-17-6-2-1-3-7-17)30(27,28)19-10-8-18(9-11-19)29(25,26)22-13-4-5-14-22/h1-3,6-11H,4-5,12-16H2,(H2,21,24)