6-[[3-azanyl-4-(2-cyanopiperidin-1-yl)-4-oxidanylidene-butyl]amino]pyridine-3-carbonitrile

Systemtic Name: 6-[[3-azanyl-4-(2-cyanopiperidin-1-yl)-4-oxidanylidene-butyl]amino]pyridine-3-carbonitrile Openeye Name: 6-[[3-amino-4-(2-cyano-1-piperidyl)-4-oxo-butyl]amino]pyridine-3-carbonitrile CAS Name: 6-[[3-amino-4-(2-cyano-1-piperidinyl)-4-oxobutyl]amino]-3-pyridinecarbonitrile IUPAC Name: 6-[[3-amino-4-(2-cyanopiperidin-1-yl)-4-oxobutyl]amino]pyridine-3-carbonitrile Traditional Name: 6-[[3-amino-4-(2-cyanopiperidino)-4-keto-butyl]amino]nicotinonitrile Formula: C16H20N6O MolecularWeight: 312.3696

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C#N)C(=O)C(CCNC2=NC=C(C=C2)C#N)N

Isomeric SMILES

C1CCN(C(C1)C#N)C(=O)C(CCNC2=NC=C(C=C2)C#N)N

InChI

InChI=1S/C16H20N6O/c17-9-12-4-5-15(21-11-12)20-7-6-14(19)16(23)22-8-2-1-3-13(22)10-18/h4-5,11,13-14H,1-3,6-8,19H2,(H,20,21)