1,3-bis(oxidanylidene)-2-phenethyl-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]isoindole-5-carboxamide

Systemtic Name: 1,3-bis(oxidanylidene)-2-phenethyl-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]isoindole-5-carboxamide Openeye Name: 1,3-dioxo-2-phenethyl-N-[2-(thiazol-2-ylcarbamoyl)phenyl]isoindoline-5-carboxamide CAS Name: 1,3-dioxo-N-[2-[oxo-(2-thiazolylamino)methyl]phenyl]-2-phenethyl-5-isoindolecarboxamide IUPAC Name: 1,3-dioxo-2-phenethyl-N-[2-(1,3-thiazol-2-ylcarbamoyl)phenyl]isoindole-5-carboxamide Traditional Name: 1,3-diketo-2-phenethyl-N-[2-(thiazol-2-ylcarbamoyl)phenyl]isoindoline-5-carboxamide Formula: C27H20N4O4S MolecularWeight: 496.5371

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC=C4C(=O)NC5=NC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NC4=CC=CC=C4C(=O)NC5=NC=CS5

InChI

InChI=1S/C27H20N4O4S/c32-23(29-22-9-5-4-8-20(22)24(33)30-27-28-13-15-36-27)18-10-11-19-21(16-18)26(35)31(25(19)34)14-12-17-6-2-1-3-7-17/h1-11,13,15-16H,12,14H2,(H,29,32)(H,28,30,33)