N-[3-cyano-4-(4-ethylphenyl)thiophen-2-yl]-4-nitro-benzamide

Systemtic Name: N-[3-cyano-4-(4-ethylphenyl)thiophen-2-yl]-4-nitro-benzamide Openeye Name: N-[3-cyano-4-(4-ethylphenyl)-2-thienyl]-4-nitro-benzamide CAS Name: N-[3-cyano-4-(4-ethylphenyl)-2-thiophenyl]-4-nitrobenzamide IUPAC Name: N-[3-cyano-4-(4-ethylphenyl)thiophen-2-yl]-4-nitrobenzamide Traditional Name: N-[3-cyano-4-(4-ethylphenyl)-2-thienyl]-4-nitro-benzamide Formula: C20H15N3O3S MolecularWeight: 377.4164

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=C2C#N)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H15N3O3S/c1-2-13-3-5-14(6-4-13)18-12-27-20(17(18)11-21)22-19(24)15-7-9-16(10-8-15)23(25)26/h3-10,12H,2H2,1H3,(H,22,24)