4-oxidanylidene-3-propyl-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-propyl-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]phthalazine-1-carboxamide Openeye Name: 4-oxo-3-propyl-N-[[2-(2-thienyl)oxazol-4-yl]methyl]phthalazine-1-carboxamide CAS Name: 4-oxo-3-propyl-N-[(2-thiophen-2-yl-4-oxazolyl)methyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-propyl-N-[(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl]phthalazine-1-carboxamide Traditional Name: 4-keto-3-propyl-N-[[2-(2-thienyl)oxazol-4-yl]methyl]phthalazine-1-carboxamide Formula: C20H18N4O3S MolecularWeight: 394.44692

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NCC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C20H18N4O3S/c1-2-9-24-20(26)15-7-4-3-6-14(15)17(23-24)18(25)21-11-13-12-27-19(22-13)16-8-5-10-28-16/h3-8,10,12H,2,9,11H2,1H3,(H,21,25)