2-[(8-fluoranyl-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenyl-ethanamide

Systemtic Name: 2-[(8-fluoranyl-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)thio]-N-phenylacetamide IUPAC Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenylacetamide Traditional Name: 2-[(8-fluoro-5H-pyridazin[4,5-b]indol-4-yl)thio]-N-phenyl-acetamide Formula: C18H13FN4OS MolecularWeight: 352.385423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=C3C(=CN=N2)C4=C(N3)C=CC(=C4)F

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=C3C(=CN=N2)C4=C(N3)C=CC(=C4)F

InChI

InChI=1S/C18H13FN4OS/c19-11-6-7-15-13(8-11)14-9-20-23-18(17(14)22-15)25-10-16(24)21-12-4-2-1-3-5-12/h1-9,22H,10H2,(H,21,24)