N-[3-[[azanyl-(cyanoamino)methylidene]amino]phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide

Systemtic Name: N-[3-[[azanyl-(cyanoamino)methylidene]amino]phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide Openeye Name: N-[3-[[amino-(cyanoamino)methylene]amino]phenyl]-3-(4-quinolylmethylamino)thiophene-2-carboxamide CAS Name: N-[3-[[amino-(cyanoamino)methylidene]amino]phenyl]-3-(4-quinolinylmethylamino)-2-thiophenecarboxamide IUPAC Name: N-[3-[[amino-(cyanoamino)methylidene]amino]phenyl]-3-(quinolin-4-ylmethylamino)thiophene-2-carboxamide Traditional Name: N-[3-[[amino-(cyanoamino)methylene]amino]phenyl]-3-(4-quinolylmethylamino)thiophene-2-carboxamide Formula: C23H19N7OS MolecularWeight: 441.50826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC=N2)CNC3=C(SC=C3)C(=O)NC4=CC=CC(=C4)N=C(N)NC#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC=N2)CNC3=C(SC=C3)C(=O)NC4=CC=CC(=C4)N=C(N)NC#N

InChI

InChI=1S/C23H19N7OS/c24-14-28-23(25)30-17-5-3-4-16(12-17)29-22(31)21-20(9-11-32-21)27-13-15-8-10-26-19-7-2-1-6-18(15)19/h1-12,27H,13H2,(H,29,31)(H3,25,28,30)