N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(cyclopropylsulfamoyl)benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(cyclopropylsulfamoyl)benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(cyclopropylsulfamoyl)benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-3-(cyclopropylsulfamoyl)benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-3-(cyclopropylsulfamoyl)benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-3-(cyclopropylsulfamoyl)benzamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC=CC(=C2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H21N3O3S2/c21-13-16-4-1-2-5-17(16)14-27-11-10-22-20(24)15-6-3-7-19(12-15)28(25,26)23-18-8-9-18/h1-7,12,18,23H,8-11,14H2,(H,22,24)