(2S)-N-(3-methyl-2-phenyl-butyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-(3-methyl-2-phenyl-butyl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxamide Openeye Name: (2S)-N-(3-methyl-2-phenyl-butyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-(3-methyl-2-phenylbutyl)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-(3-methyl-2-phenylbutyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-(3-methyl-2-phenyl-butyl)-1-(2-thenoyl)pyrrolidine-2-carboxamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CNC(=O)C1CCCN1C(=O)C2=CC=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)C(CNC(=O)[C@@H]1CCCN1C(=O)C2=CC=CS2)C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2S/c1-15(2)17(16-8-4-3-5-9-16)14-22-20(24)18-10-6-12-23(18)21(25)19-11-7-13-26-19/h3-5,7-9,11,13,15,17-18H,6,10,12,14H2,1-2H3,(H,22,24)/t17?,18-/m0/s1