N-[(Z)-1-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)heptan-3-ylideneamino]pyridine-4-carboxamide

Systemtic Name: N-[(Z)-1-(5-oxidanylidene-2-sulfanylidene-imidazolidin-4-yl)heptan-3-ylideneamino]pyridine-4-carboxamide Openeye Name: N-[(Z)-1-[2-(5-oxo-2-thioxo-imidazolidin-4-yl)ethyl]pentylideneamino]pyridine-4-carboxamide CAS Name: N-[(Z)-1-(5-oxo-2-sulfanylidene-4-imidazolidinyl)heptan-3-ylideneamino]-4-pyridinecarboxamide IUPAC Name: N-[(Z)-1-(5-oxo-2-sulfanylideneimidazolidin-4-yl)heptan-3-ylideneamino]pyridine-4-carboxamide Traditional Name: N-[(Z)-1-[2-(5-keto-2-thioxo-imidazolidin-4-yl)ethyl]pentylideneamino]isonicotinamide Formula: C16H21N5O2S MolecularWeight: 347.43524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=NNC(=O)C1=CC=NC=C1)CCC2C(=O)NC(=S)N2

Isomeric SMILES

CCCC/C(=N/NC(=O)C1=CC=NC=C1)/CCC2C(=O)NC(=S)N2

InChI

InChI=1S/C16H21N5O2S/c1-2-3-4-12(5-6-13-15(23)19-16(24)18-13)20-21-14(22)11-7-9-17-10-8-11/h7-10,13H,2-6H2,1H3,(H,21,22)(H2,18,19,23,24)/b20-12-