5-nitro-N-[(1,2,5-trimethylpyrrol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide

Systemtic Name: 5-nitro-N-[(1,2,5-trimethylpyrrol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide Openeye Name: 5-nitro-N-[(1,2,5-trimethylpyrrol-3-yl)methyleneamino]benzothiophene-2-carboxamide CAS Name: 5-nitro-N-[(1,2,5-trimethyl-3-pyrrolyl)methylideneamino]-1-benzothiophene-2-carboxamide IUPAC Name: 5-nitro-N-[(1,2,5-trimethylpyrrol-3-yl)methylideneamino]-1-benzothiophene-2-carboxamide Traditional Name: 5-nitro-N-[(1,2,5-trimethylpyrrol-3-yl)methyleneamino]benzothiophene-2-carboxamide Formula: C17H16N4O3S MolecularWeight: 356.39894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C)C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(N1C)C)C=NNC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H16N4O3S/c1-10-6-13(11(2)20(10)3)9-18-19-17(22)16-8-12-7-14(21(23)24)4-5-15(12)25-16/h4-9H,1-3H3,(H,19,22)