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

Systemtic Name: 2-[(8-fluoranyl-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)thio]-N-phenethylacetamide IUPAC Name: 2-[(8-fluoro-5H-pyridazino[4,5-b]indol-4-yl)sulfanyl]-N-phenethylacetamide Traditional Name: 2-[(8-fluoro-5H-pyridazin[4,5-b]indol-4-yl)thio]-N-phenethyl-acetamide Formula: C20H17FN4OS MolecularWeight: 380.438583

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17FN4OS/c21-14-6-7-17-15(10-14)16-11-23-25-20(19(16)24-17)27-12-18(26)22-9-8-13-4-2-1-3-5-13/h1-7,10-11,24H,8-9,12H2,(H,22,26)