2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-pyridin-2-ylethyl)butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-pyridin-2-ylethyl)butanamide Openeye Name: 4-methylsulfanyl-2-(p-tolylsulfonylamino)-N-[2-(2-pyridyl)ethyl]butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[2-(2-pyridinyl)ethyl]butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-(2-pyridin-2-ylethyl)butanamide Traditional Name: 4-(methylthio)-N-[2-(2-pyridyl)ethyl]-2-(tosylamino)butyramide Formula: C19H25N3O3S2 MolecularWeight: 407.5501

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCC2=CC=CC=N2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCCC2=CC=CC=N2

InChI

InChI=1S/C19H25N3O3S2/c1-15-6-8-17(9-7-15)27(24,25)22-18(11-14-26-2)19(23)21-13-10-16-5-3-4-12-20-16/h3-9,12,18,22H,10-11,13-14H2,1-2H3,(H,21,23)