N-(7H-purin-6-yl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(7H-purin-6-yl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(7H-purin-6-yl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(7H-purin-6-yl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(7H-purin-6-yl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(7H-purin-6-yl)-2-(2-thienyl)cinchoninamide Formula: C19H12N6OS MolecularWeight: 372.40318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC=NC5=C4NC=N5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC=NC5=C4NC=N5

InChI

InChI=1S/C19H12N6OS/c26-19(25-18-16-17(21-9-20-16)22-10-23-18)12-8-14(15-6-3-7-27-15)24-13-5-2-1-4-11(12)13/h1-10H,(H2,20,21,22,23,25,26)