4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 4-[5-bromanyl-1,3-bis(oxidanylidene)isoindol-2-yl]-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 4-(5-bromo-1,3-dioxo-isoindolin-2-yl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 4-(5-bromo-1,3-dioxo-2-isoindolyl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 4-(5-bromo-1,3-dioxoisoindol-2-yl)-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 4-(5-bromo-1,3-diketo-isoindolin-2-yl)-N-[5-(ethylthio)-1,3,4-thiadiazol-2-yl]butyramide Formula: C16H15BrN4O3S2 MolecularWeight: 455.3493

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCSC1=NN=C(S1)NC(=O)CCCN2C(=O)C3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C16H15BrN4O3S2/c1-2-25-16-20-19-15(26-16)18-12(22)4-3-7-21-13(23)10-6-5-9(17)8-11(10)14(21)24/h5-6,8H,2-4,7H2,1H3,(H,18,19,22)