3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N,N-bis(thiophen-2-ylmethyl)propanamide

Systemtic Name: 3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N,N-bis(thiophen-2-ylmethyl)propanamide Openeye Name: 3-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N,N-bis(2-thienylmethyl)propanamide CAS Name: 3-(5-bromo-1,3-dioxo-2-isoindolyl)-N,N-bis(thiophen-2-ylmethyl)propanamide IUPAC Name: 3-(5-bromo-1,3-dioxoisoindol-2-yl)-N,N-bis(thiophen-2-ylmethyl)propanamide Traditional Name: 3-(5-bromo-1,3-diketo-isoindolin-2-yl)-N,N-bis(2-thenyl)propionamide Formula: C21H17BrN2O3S2 MolecularWeight: 489.40528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CN(CC2=CC=CS2)C(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

Isomeric SMILES

C1=CSC(=C1)CN(CC2=CC=CS2)C(=O)CCN3C(=O)C4=C(C3=O)C=C(C=C4)Br

InChI

InChI=1S/C21H17BrN2O3S2/c22-14-5-6-17-18(11-14)21(27)24(20(17)26)8-7-19(25)23(12-15-3-1-9-28-15)13-16-4-2-10-29-16/h1-6,9-11H,7-8,12-13H2