(2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide

Systemtic Name: (2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide Openeye Name: (2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(4-pyridylmethyl)pyrrolidine-2-carboxamide CAS Name: (2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(pyridin-4-ylmethyl)-2-pyrrolidinecarboxamide IUPAC Name: (2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(pyridin-4-ylmethyl)pyrrolidine-2-carboxamide Traditional Name: (2S,4S)-4-(cycloheptylamino)-N,N-diethyl-1-(4-pyridylmethyl)pyrrolidine-2-carboxamide Formula: C22H36N4O MolecularWeight: 372.54744

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1CC(CN1CC2=CC=NC=C2)NC3CCCCCC3

Isomeric SMILES

CCN(CC)C(=O)[C@@H]1C[C@@H](CN1CC2=CC=NC=C2)NC3CCCCCC3

InChI

InChI=1S/C22H36N4O/c1-3-25(4-2)22(27)21-15-20(24-19-9-7-5-6-8-10-19)17-26(21)16-18-11-13-23-14-12-18/h11-14,19-21,24H,3-10,15-17H2,1-2H3/t20-,21-/m0/s1