2-(5-chloranylthiophen-2-yl)-N-(6-nitro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-(6-nitro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-(6-nitro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-(6-nitro-1,3-benzothiazol-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-(6-nitro-1,3-benzothiazol-2-yl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-(6-nitro-1,3-benzothiazol-2-yl)cinchoninamide Formula: C21H11ClN4O3S2 MolecularWeight: 466.92004

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)NC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(S3)Cl)C(=O)NC4=NC5=C(S4)C=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C21H11ClN4O3S2/c22-19-8-7-17(30-19)16-10-13(12-3-1-2-4-14(12)23-16)20(27)25-21-24-15-6-5-11(26(28)29)9-18(15)31-21/h1-10H,(H,24,25,27)