N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[2-[(2-chlorophenyl)methylthio]ethyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[2-[(2-chlorophenyl)methylsulfanyl]ethyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[2-[(2-chlorobenzyl)thio]ethyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C21H25ClN2O4S2 MolecularWeight: 469.0172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NCCSCC3=CC=CC=C3Cl

InChI

InChI=1S/C21H25ClN2O4S2/c1-16-6-7-18(30(26,27)24-9-11-28-12-10-24)14-19(16)21(25)23-8-13-29-15-17-4-2-3-5-20(17)22/h2-7,14H,8-13,15H2,1H3,(H,23,25)