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

Systemtic Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)butanamide Openeye Name: (2S)-3-methyl-N-(2-methyl-4-pyrrolidin-1-yl-phenyl)-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[2-methyl-4-(1-pyrrolidinyl)phenyl]butanamide IUPAC Name: (2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-N-(2-methyl-4-pyrrolidin-1-ylphenyl)butanamide Traditional Name: (2S)-3-methyl-N-(2-methyl-4-pyrrolidino-phenyl)-2-(tosylamino)butyramide Formula: C23H31N3O3S MolecularWeight: 429.57554

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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=C(C=C(C=C2)N3CCCC3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NC2=C(C=C(C=C2)N3CCCC3)C

InChI

InChI=1S/C23H31N3O3S/c1-16(2)22(25-30(28,29)20-10-7-17(3)8-11-20)23(27)24-21-12-9-19(15-18(21)4)26-13-5-6-14-26/h7-12,15-16,22,25H,5-6,13-14H2,1-4H3,(H,24,27)/t22-/m0/s1