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

Systemtic Name: (2S)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Openeye Name: (2S)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-methyl-2-(p-tolylsulfonylamino)butanamide CAS Name: (2S)-N-[2-(2-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide IUPAC Name: (2S)-N-[2-(2-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanamide Traditional Name: (2S)-N-[2-(2-methoxyphenyl)-2-pyrrolidino-ethyl]-3-methyl-2-(tosylamino)butyramide Formula: C25H35N3O4S MolecularWeight: 473.6281

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC(C2=CC=CC=C2OC)N3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C(C)C)C(=O)NCC(C2=CC=CC=C2OC)N3CCCC3

InChI

InChI=1S/C25H35N3O4S/c1-18(2)24(27-33(30,31)20-13-11-19(3)12-14-20)25(29)26-17-22(28-15-7-8-16-28)21-9-5-6-10-23(21)32-4/h5-6,9-14,18,22,24,27H,7-8,15-17H2,1-4H3,(H,26,29)/t22?,24-/m0/s1