5-nitro-2-[(E)-2-thiophen-2-ylethenyl]-1,3-benzothiazole

Systemtic Name: 5-nitro-2-[(E)-2-thiophen-2-ylethenyl]-1,3-benzothiazole Openeye Name: 5-nitro-2-[(E)-2-(2-thienyl)vinyl]-1,3-benzothiazole CAS Name: 5-nitro-2-[(E)-2-thiophen-2-ylethenyl]-1,3-benzothiazole IUPAC Name: 5-nitro-2-[(E)-2-thiophen-2-ylethenyl]-1,3-benzothiazole Traditional Name: 5-nitro-2-[(E)-2-(2-thienyl)vinyl]-1,3-benzothiazole Formula: C13H8N2O2S2 MolecularWeight: 288.34482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C=CC2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)/C=C/C2=NC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C13H8N2O2S2/c16-15(17)9-3-5-12-11(8-9)14-13(19-12)6-4-10-2-1-7-18-10/h1-8H/b6-4+