N-[(5-nitrothiophen-2-yl)methylideneamino]imidazo[2,1-a]isoquinoline-2-carboxamide

Systemtic Name: N-[(5-nitrothiophen-2-yl)methylideneamino]imidazo[2,1-a]isoquinoline-2-carboxamide Openeye Name: N-[(5-nitro-2-thienyl)methyleneamino]imidazo[2,1-a]isoquinoline-2-carboxamide CAS Name: N-[(5-nitro-2-thiophenyl)methylideneamino]-2-imidazo[2,1-a]isoquinolinecarboxamide IUPAC Name: N-[(5-nitrothiophen-2-yl)methylideneamino]imidazo[2,1-a]isoquinoline-2-carboxamide Traditional Name: N-[(5-nitro-2-thienyl)methyleneamino]imidaz[2,1-a]isoquinoline-2-carboxamide Formula: C17H11N5O3S MolecularWeight: 365.36594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN3C2=NC(=C3)C(=O)NN=CC4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C=CN3C2=NC(=C3)C(=O)NN=CC4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C17H11N5O3S/c23-17(20-18-9-12-5-6-15(26-12)22(24)25)14-10-21-8-7-11-3-1-2-4-13(11)16(21)19-14/h1-10H,(H,20,23)