1-(4-methylpentyl)-N-(4-phenylbutyl)-2-(thiophen-2-ylcarbonylamino)pyrrolidine-2-carboxamide

Systemtic Name: 1-(4-methylpentyl)-N-(4-phenylbutyl)-2-(thiophen-2-ylcarbonylamino)pyrrolidine-2-carboxamide Openeye Name: 1-isohexyl-N-(4-phenylbutyl)-2-(thiophene-2-carbonylamino)pyrrolidine-2-carboxamide CAS Name: 1-(4-methylpentyl)-2-[[oxo(thiophen-2-yl)methyl]amino]-N-(4-phenylbutyl)-2-pyrrolidinecarboxamide IUPAC Name: 1-(4-methylpentyl)-N-(4-phenylbutyl)-2-(thiophene-2-carbonylamino)pyrrolidine-2-carboxamide Traditional Name: 1-isohexyl-N-(4-phenylbutyl)-2-(2-thenoylamino)pyrrolidine-2-carboxamide Formula: C26H37N3O2S MolecularWeight: 455.65588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CC(C)CCCN1CCCC1(C(=O)NCCCCC2=CC=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C26H37N3O2S/c1-21(2)11-8-18-29-19-10-16-26(29,28-24(30)23-15-9-20-32-23)25(31)27-17-7-6-14-22-12-4-3-5-13-22/h3-5,9,12-13,15,20-21H,6-8,10-11,14,16-19H2,1-2H3,(H,27,31)(H,28,30)