4-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]benzamide

Systemtic Name: 4-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methylideneamino]benzamide Openeye Name: 4-nitro-N-[(E)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]benzamide CAS Name: 4-nitro-N-[(E)-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methylideneamino]benzamide IUPAC Name: 4-nitro-N-[(E)-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methylideneamino]benzamide Traditional Name: 4-nitro-N-[(E)-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyleneamino]benzamide Formula: C21H15N5O3S MolecularWeight: 417.4405

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=NNC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)/C=N/NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O3S/c27-21(15-8-10-18(11-9-15)26(28)29)23-22-13-16-14-25(17-5-2-1-3-6-17)24-20(16)19-7-4-12-30-19/h1-14H,(H,23,27)/b22-13+