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

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

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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(=C4)C(=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(=C4)C(=O)NC5=NC=CS5

InChI

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