5-bromanyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide

Systemtic Name: 5-bromanyl-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide Openeye Name: N-(5-allylsulfanyl-1,3,4-thiadiazol-2-yl)-5-bromo-pyridine-3-carboxamide CAS Name: 5-bromo-N-[5-(prop-2-enylthio)-1,3,4-thiadiazol-2-yl]-3-pyridinecarboxamide IUPAC Name: 5-bromo-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)pyridine-3-carboxamide Traditional Name: N-[5-(allylthio)-1,3,4-thiadiazol-2-yl]-5-bromo-nicotinamide Formula: C11H9BrN4OS2 MolecularWeight: 357.24936

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NN=C(S1)NC(=O)C2=CC(=CN=C2)Br

Isomeric SMILES

C=CCSC1=NN=C(S1)NC(=O)C2=CC(=CN=C2)Br

InChI

InChI=1S/C11H9BrN4OS2/c1-2-3-18-11-16-15-10(19-11)14-9(17)7-4-8(12)6-13-5-7/h2,4-6H,1,3H2,(H,14,15,17)