3,4-bis(chloranyl)-N-(1H-1,2,4-triazol-5-yl)-1-benzothiophene-2-carboximidate

Systemtic Name: 3,4-bis(chloranyl)-N-(1H-1,2,4-triazol-5-yl)-1-benzothiophene-2-carboximidate Openeye Name: 3,4-dichloro-N-(1H-1,2,4-triazol-5-yl)benzothiophene-2-carboximidate CAS Name: 3,4-dichloro-N-(1H-1,2,4-triazol-5-yl)-1-benzothiophene-2-carboximidate IUPAC Name: 3,4-dichloro-N-(1H-1,2,4-triazol-5-yl)-1-benzothiophene-2-carboximidate Traditional Name: 3,4-dichloro-N-(1H-1,2,4-triazol-5-yl)benzothiophene-2-carboximidate Formula: C11H5Cl2N4OS- MolecularWeight: 312.1546

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)C(=C(S2)C(=NC3=NC=NN3)[O-])Cl

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)C(=C(S2)C(=NC3=NC=NN3)[O-])Cl

InChI

InChI=1S/C11H6Cl2N4OS/c12-5-2-1-3-6-7(5)8(13)9(19-6)10(18)16-11-14-4-15-17-11/h1-4H,(H2,14,15,16,17,18)/p-1