3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide

Systemtic Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide Openeye Name: 3-methyl-2-(p-tolylsulfonylamino)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide CAS Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]butanamide IUPAC Name: 3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]butanamide Traditional Name: 3-methyl-N-[4-(pyrrolidinomethyl)benzyl]-2-(tosylamino)butyramide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C24H33N3O3S/c1-18(2)23(26-31(29,30)22-12-6-19(3)7-13-22)24(28)25-16-20-8-10-21(11-9-20)17-27-14-4-5-15-27/h6-13,18,23,26H,4-5,14-17H2,1-3H3,(H,25,28)