5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[3-(1-pyrazolylmethyl)phenyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[3-(pyrazol-1-ylmethyl)phenyl]benzothiophene-2-carboxamide Formula: C19H14N4O3S MolecularWeight: 378.40446

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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-])CN4C=CC=N4

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-])CN4C=CC=N4

InChI

InChI=1S/C19H14N4O3S/c24-19(18-11-14-10-16(23(25)26)5-6-17(14)27-18)21-15-4-1-3-13(9-15)12-22-8-2-7-20-22/h1-11H,12H2,(H,21,24)