N-[(E)-[4-oxidanylidene-4-[(phenylmethyl)amino]butan-2-ylidene]amino]pyridine-3-carboxamide

Systemtic Name: N-[(E)-[4-oxidanylidene-4-[(phenylmethyl)amino]butan-2-ylidene]amino]pyridine-3-carboxamide Openeye Name: N-[(E)-[3-(benzylamino)-1-methyl-3-oxo-propylidene]amino]pyridine-3-carboxamide CAS Name: N-[(E)-[4-oxo-4-[(phenylmethyl)amino]butan-2-ylidene]amino]-3-pyridinecarboxamide IUPAC Name: N-[(E)-[4-(benzylamino)-4-oxobutan-2-ylidene]amino]pyridine-3-carboxamide Traditional Name: N-[(E)-[3-(benzylamino)-3-keto-1-methyl-propylidene]amino]nicotinamide Formula: C17H18N4O2 MolecularWeight: 310.35042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CN=CC=C1)CC(=O)NCC2=CC=CC=C2

Isomeric SMILES

C/C(=N\NC(=O)C1=CN=CC=C1)/CC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C17H18N4O2/c1-13(20-21-17(23)15-8-5-9-18-12-15)10-16(22)19-11-14-6-3-2-4-7-14/h2-9,12H,10-11H2,1H3,(H,19,22)(H,21,23)/b20-13+