3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)butanamide

Systemtic Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)butanamide Openeye Name: 3-methyl-2-(p-tolylsulfonylamino)-N-(6-pyrrolidin-1-yl-3-pyridyl)butanamide CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[6-(1-pyrrolidinyl)-3-pyridinyl]butanamide IUPAC Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(6-pyrrolidin-1-ylpyridin-3-yl)butanamide Traditional Name: 3-methyl-N-(6-pyrrolidino-3-pyridyl)-2-(tosylamino)butyramide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NC2=CN=C(C=C2)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NC2=CN=C(C=C2)N3CCCC3

InChI

InChI=1S/C21H28N4O3S/c1-15(2)20(24-29(27,28)18-9-6-16(3)7-10-18)21(26)23-17-8-11-19(22-14-17)25-12-4-5-13-25/h6-11,14-15,20,24H,4-5,12-13H2,1-3H3,(H,23,26)