(3S)-1-[2-[(2S)-butan-2-yl]phenyl]-5-oxidanylidene-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-[2-[(2S)-butan-2-yl]phenyl]-5-oxidanylidene-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide Openeye Name: (3S)-1-[2-[(1S)-1-methylpropyl]phenyl]-5-oxo-N-(4-pyridylmethyl)pyrrolidine-3-carboxamide CAS Name: (3S)-1-[2-[(2S)-butan-2-yl]phenyl]-5-oxo-N-(pyridin-4-ylmethyl)-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-[2-[(2S)-butan-2-yl]phenyl]-5-oxo-N-(pyridin-4-ylmethyl)pyrrolidine-3-carboxamide Traditional Name: (3S)-5-keto-1-[2-[(1S)-1-methylpropyl]phenyl]-N-(4-pyridylmethyl)pyrrolidine-3-carboxamide Formula: C21H25N3O2 MolecularWeight: 351.4421

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1N2CC(CC2=O)C(=O)NCC3=CC=NC=C3

Isomeric SMILES

CC[C@H](C)C1=CC=CC=C1N2C[C@H](CC2=O)C(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C21H25N3O2/c1-3-15(2)18-6-4-5-7-19(18)24-14-17(12-20(24)25)21(26)23-13-16-8-10-22-11-9-16/h4-11,15,17H,3,12-14H2,1-2H3,(H,23,26)/t15-,17-/m0/s1