N-(3-cyano-5-ethyl-thiophen-2-yl)-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-(3-cyano-5-ethyl-thiophen-2-yl)-4-ethoxy-3-nitro-benzamide Openeye Name: N-(3-cyano-5-ethyl-2-thienyl)-4-ethoxy-3-nitro-benzamide CAS Name: N-(3-cyano-5-ethyl-2-thiophenyl)-4-ethoxy-3-nitrobenzamide IUPAC Name: N-(3-cyano-5-ethylthiophen-2-yl)-4-ethoxy-3-nitrobenzamide Traditional Name: N-(3-cyano-5-ethyl-2-thienyl)-4-ethoxy-3-nitro-benzamide Formula: C16H15N3O4S MolecularWeight: 345.373

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-])C#N

Isomeric SMILES

CCC1=CC(=C(S1)NC(=O)C2=CC(=C(C=C2)OCC)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H15N3O4S/c1-3-12-7-11(9-17)16(24-12)18-15(20)10-5-6-14(23-4-2)13(8-10)19(21)22/h5-8H,3-4H2,1-2H3,(H,18,20)