2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carbaldehyde

Systemtic Name: 2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carbaldehyde Openeye Name: 2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carbaldehyde CAS Name: 2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carboxaldehyde IUPAC Name: 2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carbaldehyde Traditional Name: 2,5-bis(1,3-benzodithiol-2-yl)-1H-pyrrole-3-carbaldehyde Formula: C19H13NOS4 MolecularWeight: 399.57262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)SC(S2)C3=CC(=C(N3)C4SC5=CC=CC=C5S4)C=O

Isomeric SMILES

C1=CC=C2C(=C1)SC(S2)C3=CC(=C(N3)C4SC5=CC=CC=C5S4)C=O

InChI

InChI=1S/C19H13NOS4/c21-10-11-9-12(18-22-13-5-1-2-6-14(13)23-18)20-17(11)19-24-15-7-3-4-8-16(15)25-19/h1-10,18-20H