N-[2-(4-chlorophenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(1-pyrrolidinylsulfonyl)-1H-pyrrole-2-carboxamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-pyrrolidin-1-ylsulfonyl-1H-pyrrole-2-carboxamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-pyrrolidinosulfonyl-1H-pyrrole-2-carboxamide Formula: C17H20ClN3O3S2 MolecularWeight: 413.942

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CNC(=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H20ClN3O3S2/c18-13-3-5-14(6-4-13)25-10-7-19-17(22)16-11-15(12-20-16)26(23,24)21-8-1-2-9-21/h3-6,11-12,20H,1-2,7-10H2,(H,19,22)