N-[2-(4-methylsulfanylphenyl)ethyl]-2-(4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanamide

Systemtic Name: N-[2-(4-methylsulfanylphenyl)ethyl]-2-(4-oxidanylidene-2H-pyridazino[4,5-b]indol-3-yl)ethanamide Openeye Name: N-[2-(4-methylsulfanylphenyl)ethyl]-2-(4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetamide CAS Name: N-[2-[4-(methylthio)phenyl]ethyl]-2-(4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetamide IUPAC Name: N-[2-(4-methylsulfanylphenyl)ethyl]-2-(4-oxo-2H-pyridazino[4,5-b]indol-3-yl)acetamide Traditional Name: 2-(4-keto-2H-pyridazin[4,5-b]indol-3-yl)-N-[2-[4-(methylthio)phenyl]ethyl]acetamide Formula: C21H20N4O2S MolecularWeight: 392.4741

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)CCNC(=O)CN2C(=O)C3=NC4=CC=CC=C4C3=CN2

Isomeric SMILES

CSC1=CC=C(C=C1)CCNC(=O)CN2C(=O)C3=NC4=CC=CC=C4C3=CN2

InChI

InChI=1S/C21H20N4O2S/c1-28-15-8-6-14(7-9-15)10-11-22-19(26)13-25-21(27)20-17(12-23-25)16-4-2-3-5-18(16)24-20/h2-9,12,23H,10-11,13H2,1H3,(H,22,26)