N-[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[3-(1,3-dioxoisoindolin-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[3-(1,3-dioxo-2-isoindolyl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[3-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[(3-phthalimidophenyl)thiocarbamoyl]thiophene-2-carboxamide Formula: C20H13N3O3S2 MolecularWeight: 407.46552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CS4

InChI

InChI=1S/C20H13N3O3S2/c24-17(16-9-4-10-28-16)22-20(27)21-12-5-3-6-13(11-12)23-18(25)14-7-1-2-8-15(14)19(23)26/h1-11H,(H2,21,22,24,27)