N-[bis(azanyl)methylidene]-2-(5-fluoranyl-2-methyl-phenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(5-fluoranyl-2-methyl-phenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(5-fluoro-2-methyl-phenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(5-fluoro-2-methylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(5-fluoro-2-methylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(5-fluoro-2-methyl-phenyl)-1-keto-isoquinoline-4-carboxamide Formula: C18H15FN4O2 MolecularWeight: 338.335703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)F)N2C=C(C3=CC=CC=C3C2=O)C(=O)N=C(N)N

Isomeric SMILES

CC1=C(C=C(C=C1)F)N2C=C(C3=CC=CC=C3C2=O)C(=O)N=C(N)N

InChI

InChI=1S/C18H15FN4O2/c1-10-6-7-11(19)8-15(10)23-9-14(16(24)22-18(20)21)12-4-2-3-5-13(12)17(23)25/h2-9H,1H3,(H4,20,21,22,24)