N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-(cyclopropylsulfamoyl)-2-methylbenzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-5-(cyclopropylsulfamoyl)-2-methyl-benzamide Formula: C21H23N3O3S2 MolecularWeight: 429.55562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2CC2)C(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C21H23N3O3S2/c1-15-6-9-19(29(26,27)24-18-7-8-18)12-20(15)21(25)23-10-11-28-14-17-5-3-2-4-16(17)13-22/h2-6,9,12,18,24H,7-8,10-11,14H2,1H3,(H,23,25)