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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1N=C(S2)N3C=CC=C3C=O)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC2=C1N=C(S2)N3C=CC=C3C=O)[N+](=O)[O-]

InChI

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