N-[3-(5-chloranylthiophen-2-yl)-1-phenyl-pyrazol-4-yl]-4-nitro-benzamide

Systemtic Name: N-[3-(5-chloranylthiophen-2-yl)-1-phenyl-pyrazol-4-yl]-4-nitro-benzamide Openeye Name: N-[3-(5-chloro-2-thienyl)-1-phenyl-pyrazol-4-yl]-4-nitro-benzamide CAS Name: N-[3-(5-chloro-2-thiophenyl)-1-phenyl-4-pyrazolyl]-4-nitrobenzamide IUPAC Name: N-[3-(5-chlorothiophen-2-yl)-1-phenylpyrazol-4-yl]-4-nitrobenzamide Traditional Name: N-[3-(5-chloro-2-thienyl)-1-phenyl-pyrazol-4-yl]-4-nitro-benzamide Formula: C20H13ClN4O3S MolecularWeight: 424.86022

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)Cl)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(S3)Cl)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H13ClN4O3S/c21-18-11-10-17(29-18)19-16(12-24(23-19)14-4-2-1-3-5-14)22-20(26)13-6-8-15(9-7-13)25(27)28/h1-12H,(H,22,26)