N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[isopropyl(methyl)sulfamoyl]benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-[methyl(propan-2-yl)sulfamoyl]benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-[isopropyl(methyl)sulfamoyl]benzamide Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CC(C)N(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C21H25N3O3S2/c1-16(2)24(3)29(26,27)20-10-8-17(9-11-20)21(25)23-12-13-28-15-19-7-5-4-6-18(19)14-22/h4-11,16H,12-13,15H2,1-3H3,(H,23,25)