N-[5-azanyl-6-[(2S)-2-cyanopyrrolidin-1-yl]-6-oxidanylidene-hexyl]-4-cyano-pyridine-2-carboxamide

Systemtic Name: N-[5-azanyl-6-[(2S)-2-cyanopyrrolidin-1-yl]-6-oxidanylidene-hexyl]-4-cyano-pyridine-2-carboxamide Openeye Name: N-[5-amino-6-[(2S)-2-cyanopyrrolidin-1-yl]-6-oxo-hexyl]-4-cyano-pyridine-2-carboxamide CAS Name: N-[5-amino-6-[(2S)-2-cyano-1-pyrrolidinyl]-6-oxohexyl]-4-cyano-2-pyridinecarboxamide IUPAC Name: N-[5-amino-6-[(2S)-2-cyanopyrrolidin-1-yl]-6-oxohexyl]-4-cyanopyridine-2-carboxamide Traditional Name: N-[5-amino-6-[(2S)-2-cyanopyrrolidino]-6-keto-hexyl]-4-cyano-picolinamide Formula: C18H22N6O2 MolecularWeight: 354.40628

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)C(CCCCNC(=O)C2=NC=CC(=C2)C#N)N)C#N

Isomeric SMILES

C1C[C@H](N(C1)C(=O)C(CCCCNC(=O)C2=NC=CC(=C2)C#N)N)C#N

InChI

InChI=1S/C18H22N6O2/c19-11-13-6-8-22-16(10-13)17(25)23-7-2-1-5-15(21)18(26)24-9-3-4-14(24)12-20/h6,8,10,14-15H,1-5,7,9,21H2,(H,23,25)/t14-,15?/m0/s1