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

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-4-nitro-benzamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-4-nitro-benzamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-4-nitrobenzamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-4-nitrobenzamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-4-nitro-benzamide Formula: C15H13N3O3S MolecularWeight: 315.34702

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C15H13N3O3S/c1-3-12-9(2)22-15(13(12)8-16)17-14(19)10-4-6-11(7-5-10)18(20)21/h4-7H,3H2,1-2H3,(H,17,19)