N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide Openeye Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-(morpholinosulfonylmethyl)benzamide CAS Name: N-[2-[(3-chlorophenyl)methylthio]ethyl]-4-(4-morpholinylsulfonylmethyl)benzamide IUPAC Name: N-[2-[(3-chlorophenyl)methylsulfanyl]ethyl]-4-(morpholin-4-ylsulfonylmethyl)benzamide Traditional Name: N-[2-[(3-chlorobenzyl)thio]ethyl]-4-(morpholinosulfonylmethyl)benzamide Formula: C21H25ClN2O4S2 MolecularWeight: 469.0172

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)CC2=CC=C(C=C2)C(=O)NCCSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H25ClN2O4S2/c22-20-3-1-2-18(14-20)15-29-13-8-23-21(25)19-6-4-17(5-7-19)16-30(26,27)24-9-11-28-12-10-24/h1-7,14H,8-13,15-16H2,(H,23,25)