N-[(E)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]pyridine-4-carboxamide

Systemtic Name: N-[(E)-[4-(1-adamantylamino)-4-oxidanylidene-butan-2-ylidene]amino]pyridine-4-carboxamide Openeye Name: N-[(E)-[3-(1-adamantylamino)-1-methyl-3-oxo-propylidene]amino]pyridine-4-carboxamide CAS Name: N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]-4-pyridinecarboxamide IUPAC Name: N-[(E)-[4-(1-adamantylamino)-4-oxobutan-2-ylidene]amino]pyridine-4-carboxamide Traditional Name: N-[(E)-[3-(1-adamantylamino)-3-keto-1-methyl-propylidene]amino]isonicotinamide Formula: C20H26N4O2 MolecularWeight: 354.44604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CC=NC=C1)CC(=O)NC23CC4CC(C2)CC(C4)C3

Isomeric SMILES

C/C(=N\NC(=O)C1=CC=NC=C1)/CC(=O)NC23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C20H26N4O2/c1-13(23-24-19(26)17-2-4-21-5-3-17)6-18(25)22-20-10-14-7-15(11-20)9-16(8-14)12-20/h2-5,14-16H,6-12H2,1H3,(H,22,25)(H,24,26)/b23-13+