N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide

Systemtic Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide Openeye Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide CAS Name: N-[2-[(2,4-dichlorophenyl)methylthio]ethyl]-4-(1-pyrrolidinylmethyl)benzamide IUPAC Name: N-[2-[(2,4-dichlorophenyl)methylsulfanyl]ethyl]-4-(pyrrolidin-1-ylmethyl)benzamide Traditional Name: N-[2-[(2,4-dichlorobenzyl)thio]ethyl]-4-(pyrrolidinomethyl)benzamide Formula: C21H24Cl2N2OS MolecularWeight: 423.39906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)C(=O)NCCSCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C21H24Cl2N2OS/c22-19-8-7-18(20(23)13-19)15-27-12-9-24-21(26)17-5-3-16(4-6-17)14-25-10-1-2-11-25/h3-8,13H,1-2,9-12,14-15H2,(H,24,26)