1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde

Systemtic Name: 1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde Openeye Name: 1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde CAS Name: 1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)-2-pyrrolecarboxaldehyde IUPAC Name: 1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde Traditional Name: 1-(6-methyl-4-nitro-1,3-benzothiazol-2-yl)pyrrole-2-carbaldehyde Formula: C13H9N3O3S MolecularWeight: 287.29386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)N3C=CC=C3C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)N3C=CC=C3C=O)[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O3S/c1-8-5-10(16(18)19)12-11(6-8)20-13(14-12)15-4-2-3-9(15)7-17/h2-7H,1H3