4-[[2-(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-bromanyl-6-methoxy-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[[2-(4-azanyl-5-ethyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-bromanyl-6-methoxy-cyclohexa-2,5-dien-1-one Openeye Name: 4-[[2-(4-amino-5-ethyl-1,2,4-triazol-3-yl)hydrazino]methylene]-2-bromo-6-methoxy-cyclohexa-2,5-dien-1-one CAS Name: 4-[[(4-amino-5-ethyl-1,2,4-triazol-3-yl)hydrazo]methylidene]-2-bromo-6-methoxy-1-cyclohexa-2,5-dienone IUPAC Name: 4-[[2-(4-amino-5-ethyl-1,2,4-triazol-3-yl)hydrazinyl]methylidene]-2-bromo-6-methoxycyclohexa-2,5-dien-1-one Traditional Name: 4-[[N'-(4-amino-5-ethyl-1,2,4-triazol-3-yl)hydrazino]methylene]-2-bromo-6-methoxy-cyclohexa-2,5-dien-1-one Formula: C12H15BrN6O2 MolecularWeight: 355.1905

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(N1N)NNC=C2C=C(C(=O)C(=C2)Br)OC

Isomeric SMILES

CCC1=NN=C(N1N)NNC=C2C=C(C(=O)C(=C2)Br)OC

InChI

InChI=1S/C12H15BrN6O2/c1-3-10-16-18-12(19(10)14)17-15-6-7-4-8(13)11(20)9(5-7)21-2/h4-6,15H,3,14H2,1-2H3,(H,17,18)