N-benzo[e][1,3]benzothiazol-2-yl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-benzo[e][1,3]benzothiazol-2-yl-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-benzo[e][1,3]benzothiazol-2-yl-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-(2-benzo[e][1,3]benzothiazolyl)-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-benzo[e][1,3]benzothiazol-2-yl-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-benzo[e][1,3]benzothiazol-2-yl-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C26H16N4O2S MolecularWeight: 448.49584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC5=C(S4)C=CC6=CC=CC=C65

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NC4=NC5=C(S4)C=CC6=CC=CC=C65

InChI

InChI=1S/C26H16N4O2S/c31-24(28-26-27-22-18-11-5-4-8-16(18)14-15-21(22)33-26)23-19-12-6-7-13-20(19)25(32)30(29-23)17-9-2-1-3-10-17/h1-15H,(H,27,28,31)