N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-(4-ethyl-1,3-benzothiazol-2-yl)-4,5-dimethoxy-2-nitro-benzamide Formula: C18H17N3O5S MolecularWeight: 387.40968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C18H17N3O5S/c1-4-10-6-5-7-15-16(10)19-18(27-15)20-17(22)11-8-13(25-2)14(26-3)9-12(11)21(23)24/h5-9H,4H2,1-3H3,(H,19,20,22)