N-(4-tert-butyl-1,3-thiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide

Systemtic Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide Openeye Name: N-(4-tert-butylthiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide CAS Name: N-(4-tert-butyl-2-thiazolyl)-4-ethoxy-5-methoxy-2-nitrobenzamide IUPAC Name: N-(4-tert-butyl-1,3-thiazol-2-yl)-4-ethoxy-5-methoxy-2-nitrobenzamide Traditional Name: N-(4-tert-butylthiazol-2-yl)-4-ethoxy-5-methoxy-2-nitro-benzamide Formula: C17H21N3O5S MolecularWeight: 379.43074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C(C)(C)C)OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)[N+](=O)[O-])C(=O)NC2=NC(=CS2)C(C)(C)C)OC

InChI

InChI=1S/C17H21N3O5S/c1-6-25-13-8-11(20(22)23)10(7-12(13)24-5)15(21)19-16-18-14(9-26-16)17(2,3)4/h7-9H,6H2,1-5H3,(H,18,19,21)