N-[(2S)-butan-2-yl]-N-[3-oxidanylidene-3-(pyridin-3-ylmethylamino)propyl]furan-3-carboxamide

Systemtic Name: N-[(2S)-butan-2-yl]-N-[3-oxidanylidene-3-(pyridin-3-ylmethylamino)propyl]furan-3-carboxamide Openeye Name: N-[(1S)-1-methylpropyl]-N-[3-oxo-3-(3-pyridylmethylamino)propyl]furan-3-carboxamide CAS Name: N-[(2S)-butan-2-yl]-N-[3-oxo-3-(3-pyridinylmethylamino)propyl]-3-furancarboxamide IUPAC Name: N-[(2S)-butan-2-yl]-N-[3-oxo-3-(pyridin-3-ylmethylamino)propyl]furan-3-carboxamide Traditional Name: N-[3-keto-3-(3-pyridylmethylamino)propyl]-N-[(1S)-1-methylpropyl]-3-furamide Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CCC(=O)NCC1=CN=CC=C1)C(=O)C2=COC=C2

Isomeric SMILES

CC[C@H](C)N(CCC(=O)NCC1=CN=CC=C1)C(=O)C2=COC=C2

InChI

InChI=1S/C18H23N3O3/c1-3-14(2)21(18(23)16-7-10-24-13-16)9-6-17(22)20-12-15-5-4-8-19-11-15/h4-5,7-8,10-11,13-14H,3,6,9,12H2,1-2H3,(H,20,22)/t14-/m0/s1