4-methylsulfanyl-2-(naphthalen-2-ylsulfonylamino)-N-(2-pyridin-2-ylethyl)butanamide

Systemtic Name: 4-methylsulfanyl-2-(naphthalen-2-ylsulfonylamino)-N-(2-pyridin-2-ylethyl)butanamide Openeye Name: 4-methylsulfanyl-2-(2-naphthylsulfonylamino)-N-[2-(2-pyridyl)ethyl]butanamide CAS Name: 4-(methylthio)-2-(2-naphthalenylsulfonylamino)-N-[2-(2-pyridinyl)ethyl]butanamide IUPAC Name: 4-methylsulfanyl-2-(naphthalen-2-ylsulfonylamino)-N-(2-pyridin-2-ylethyl)butanamide Traditional Name: 4-(methylthio)-2-(2-naphthylsulfonylamino)-N-[2-(2-pyridyl)ethyl]butyramide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCCC1=CC=CC=N1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CSCCC(C(=O)NCCC1=CC=CC=N1)NS(=O)(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C22H25N3O3S2/c1-29-15-12-21(22(26)24-14-11-19-8-4-5-13-23-19)25-30(27,28)20-10-9-17-6-2-3-7-18(17)16-20/h2-10,13,16,21,25H,11-12,14-15H2,1H3,(H,24,26)