2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole

Systemtic Name: 2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole Openeye Name: 2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole CAS Name: 2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole IUPAC Name: 2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole Traditional Name: 2-(6-isocyano-2-phenyl-3H-pyrrolo[1,2-b][1,2,4]triazol-7-yl)-1,3-benzothiazole Formula: C19H11N5S MolecularWeight: 341.38914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]C1=CN2C(=C1C3=NC4=CC=CC=C4S3)N=C(N2)C5=CC=CC=C5

Isomeric SMILES

[C-]#[N+]C1=CN2C(=C1C3=NC4=CC=CC=C4S3)N=C(N2)C5=CC=CC=C5

InChI

InChI=1S/C19H11N5S/c1-20-14-11-24-18(22-17(23-24)12-7-3-2-4-8-12)16(14)19-21-13-9-5-6-10-15(13)25-19/h2-11H,(H,22,23)