6-[2-[[2-[(2S)-2-cyano-2,3-dihydropyrrol-1-yl]-2-oxidanylidene-ethyl]amino]ethylamino]pyridine-3-carbonitrile

Systemtic Name: 6-[2-[[2-[(2S)-2-cyano-2,3-dihydropyrrol-1-yl]-2-oxidanylidene-ethyl]amino]ethylamino]pyridine-3-carbonitrile Openeye Name: 6-[2-[[2-[(2S)-2-cyano-2,3-dihydropyrrol-1-yl]-2-oxo-ethyl]amino]ethylamino]pyridine-3-carbonitrile CAS Name: 6-[2-[[2-[(2S)-2-cyano-2,3-dihydropyrrol-1-yl]-2-oxoethyl]amino]ethylamino]-3-pyridinecarbonitrile IUPAC Name: 6-[2-[[2-[(2S)-2-cyano-2,3-dihydropyrrol-1-yl]-2-oxoethyl]amino]ethylamino]pyridine-3-carbonitrile Traditional Name: 6-[2-[[2-[(2S)-2-cyano-2-pyrrolin-1-yl]-2-keto-ethyl]amino]ethylamino]nicotinonitrile Formula: C15H16N6O MolecularWeight: 296.32714

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CN(C1C#N)C(=O)CNCCNC2=NC=C(C=C2)C#N

Isomeric SMILES

C1C=CN([C@@H]1C#N)C(=O)CNCCNC2=NC=C(C=C2)C#N

InChI

InChI=1S/C15H16N6O/c16-8-12-3-4-14(20-10-12)19-6-5-18-11-15(22)21-7-1-2-13(21)9-17/h1,3-4,7,10,13,18H,2,5-6,11H2,(H,19,20)/t13-/m0/s1