N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide

Systemtic Name: N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Openeye Name: N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide CAS Name: N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide IUPAC Name: N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitrobenzamide Traditional Name: N-(4,7-dimethoxy-3-propyl-1,3-benzothiazol-2-ylidene)-3-nitro-benzamide Formula: C19H19N3O5S MolecularWeight: 401.43626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC)OC

Isomeric SMILES

CCCN1C2=C(C=CC(=C2SC1=NC(=O)C3=CC(=CC=C3)[N+](=O)[O-])OC)OC

InChI

InChI=1S/C19H19N3O5S/c1-4-10-21-16-14(26-2)8-9-15(27-3)17(16)28-19(21)20-18(23)12-6-5-7-13(11-12)22(24)25/h5-9,11H,4,10H2,1-3H3