N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-[2-(methylsulfonylamino)ethyl]thiophene-2-carboxamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-5-[2-(methanesulfonamido)ethyl]-2-thiophenecarboxamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-5-[2-(methanesulfonamido)ethyl]thiophene-2-carboxamide Formula: C18H21N3O3S3 MolecularWeight: 423.57264

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CS(=O)(=O)NCCC1=CC=C(S1)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C18H21N3O3S3/c1-27(23,24)21-9-8-16-6-7-17(26-16)18(22)20-10-11-25-13-15-5-3-2-4-14(15)12-19/h2-7,21H,8-11,13H2,1H3,(H,20,22)