4-butoxy-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide

Systemtic Name: 4-butoxy-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide Openeye Name: 4-butoxy-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]benzamide CAS Name: 4-butoxy-N-[4-(4-nitro-2-thiophenyl)-2-thiazolyl]benzamide IUPAC Name: 4-butoxy-N-[4-(4-nitrothiophen-2-yl)-1,3-thiazol-2-yl]benzamide Traditional Name: 4-butoxy-N-[4-(4-nitro-2-thienyl)thiazol-2-yl]benzamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-]

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC(=CS3)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O4S2/c1-2-3-8-25-14-6-4-12(5-7-14)17(22)20-18-19-15(11-27-18)16-9-13(10-26-16)21(23)24/h4-7,9-11H,2-3,8H2,1H3,(H,19,20,22)