N'-[[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]heptanehydrazide

Systemtic Name: N'-[[4,6-bis(oxidanylidene)-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene]methyl]heptanehydrazide Openeye Name: N'-[(4,6-dioxo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]heptanehydrazide CAS Name: N'-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]heptanehydrazide IUPAC Name: N'-[(4,6-dioxo-1-phenyl-2-sulfanylidene-1,3-diazinan-5-ylidene)methyl]heptanehydrazide Traditional Name: N'-[(4,6-diketo-1-phenyl-2-thioxo-hexahydropyrimidin-5-ylidene)methyl]enanthohydrazide Formula: C18H22N4O3S MolecularWeight: 374.45728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)NNC=C1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCC(=O)NNC=C1C(=O)NC(=S)N(C1=O)C2=CC=CC=C2

InChI

InChI=1S/C18H22N4O3S/c1-2-3-4-8-11-15(23)21-19-12-14-16(24)20-18(26)22(17(14)25)13-9-6-5-7-10-13/h5-7,9-10,12,19H,2-4,8,11H2,1H3,(H,21,23)(H,20,24,26)