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

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(2-thienylsulfonylamino)benzamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-4-(thiophen-2-ylsulfonylamino)benzamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-4-(2-thienylsulfonylamino)benzamide Formula: C21H19N3O3S3 MolecularWeight: 457.58886

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3)C#N

InChI

InChI=1S/C21H19N3O3S3/c22-14-17-4-1-2-5-18(17)15-28-13-11-23-21(25)16-7-9-19(10-8-16)24-30(26,27)20-6-3-12-29-20/h1-10,12,24H,11,13,15H2,(H,23,25)