N-(3-cyanophenyl)-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-(3-cyanophenyl)-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-(3-cyanophenyl)-5-nitro-benzothiophene-2-carboxamide CAS Name: N-(3-cyanophenyl)-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-(3-cyanophenyl)-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-(3-cyanophenyl)-5-nitro-benzothiophene-2-carboxamide Formula: C16H9N3O3S MolecularWeight: 323.32596

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H9N3O3S/c17-9-10-2-1-3-12(6-10)18-16(20)15-8-11-7-13(19(21)22)4-5-14(11)23-15/h1-8H,(H,18,20)