1-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]pyrrole-2-carbaldehyde

Systemtic Name: 1-[4,5-bis(chloranyl)-1,3-benzothiazol-2-yl]pyrrole-2-carbaldehyde Openeye Name: 1-(4,5-dichloro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde CAS Name: 1-(4,5-dichloro-1,3-benzothiazol-2-yl)-2-pyrrolecarboxaldehyde IUPAC Name: 1-(4,5-dichloro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde Traditional Name: 1-(4,5-dichloro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde Formula: C12H6Cl2N2OS MolecularWeight: 297.15984

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=CC(=C3Cl)Cl

Isomeric SMILES

C1=CN(C(=C1)C=O)C2=NC3=C(S2)C=CC(=C3Cl)Cl

InChI

InChI=1S/C12H6Cl2N2OS/c13-8-3-4-9-11(10(8)14)15-12(18-9)16-5-1-2-7(16)6-17/h1-6H