N-[2-(4-chlorophenyl)sulfanylethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide CAS Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(1-pyrrolidinylsulfonylmethyl)benzamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylethyl]-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide Traditional Name: N-[2-[(4-chlorophenyl)thio]ethyl]-4-(pyrrolidinosulfonylmethyl)benzamide Formula: C20H23ClN2O3S2 MolecularWeight: 438.99122

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H23ClN2O3S2/c21-18-7-9-19(10-8-18)27-14-11-22-20(24)17-5-3-16(4-6-17)15-28(25,26)23-12-1-2-13-23/h3-10H,1-2,11-15H2,(H,22,24)