N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide

Systemtic Name: N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[2-(o-tolylmethylsulfanyl)ethyl]-4-(2-thienylsulfonylamino)benzamide CAS Name: N-[2-[(2-methylphenyl)methylthio]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[2-[(2-methylphenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[2-[(2-methylbenzyl)thio]ethyl]-4-(2-thienylsulfonylamino)benzamide Formula: C21H22N2O3S3 MolecularWeight: 446.60598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H22N2O3S3/c1-16-5-2-3-6-18(16)15-27-14-12-22-21(24)17-8-10-19(11-9-17)23-29(25,26)20-7-4-13-28-20/h2-11,13,23H,12,14-15H2,1H3,(H,22,24)