N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide

Systemtic Name: N-[2-(2-azanyl-2-oxidanylidene-ethyl)sulfanylphenyl]-3-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]propanamide Openeye Name: N-[2-(2-amino-2-oxo-ethyl)sulfanylphenyl]-3-(5-bromo-1,3-dioxo-isoindolin-2-yl)propanamide CAS Name: N-[2-[(2-amino-2-oxoethyl)thio]phenyl]-3-(5-bromo-1,3-dioxo-2-isoindolyl)propanamide IUPAC Name: N-[2-(2-amino-2-oxoethyl)sulfanylphenyl]-3-(5-bromo-1,3-dioxoisoindol-2-yl)propanamide Traditional Name: N-[2-[(2-amino-2-keto-ethyl)thio]phenyl]-3-(5-bromo-1,3-diketo-isoindolin-2-yl)propionamide Formula: C19H16BrN3O4S MolecularWeight: 462.31704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)SCC(=O)N

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCN2C(=O)C3=C(C2=O)C=C(C=C3)Br)SCC(=O)N

InChI

InChI=1S/C19H16BrN3O4S/c20-11-5-6-12-13(9-11)19(27)23(18(12)26)8-7-17(25)22-14-3-1-2-4-15(14)28-10-16(21)24/h1-6,9H,7-8,10H2,(H2,21,24)(H,22,25)