4-[5-(2-azanylthiophen-3-yl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[5-(2-azanylthiophen-3-yl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[5-(2-amino-3-thienyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[5-(2-amino-3-thiophenyl)-1,2,4-oxadiazol-3-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[5-(2-aminothiophen-3-yl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[5-(2-amino-3-thienyl)-1,2,4-oxadiazol-3-ylidene]cyclohexa-2,5-dien-1-one Formula: C12H9N3O2S MolecularWeight: 259.28376

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=O)C=CC1=C2NOC(=N2)C3=C(SC=C3)N

Isomeric SMILES

C1=CC(=O)C=CC1=C2NOC(=N2)C3=C(SC=C3)N

InChI

InChI=1S/C12H9N3O2S/c13-10-9(5-6-18-10)12-14-11(15-17-12)7-1-3-8(16)4-2-7/h1-6,15H,13H2