N-[bis(azanyl)methylidene]-2-[(4-fluorophenyl)methyl]-6-methyl-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-[(4-fluorophenyl)methyl]-6-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-[(4-fluorophenyl)methyl]-6-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-[(4-fluorophenyl)methyl]-6-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-[(4-fluorophenyl)methyl]-6-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(4-fluorobenzyl)-1-keto-6-methyl-isoquinoline-4-carboxamide Formula: C19H17FN4O2 MolecularWeight: 352.362283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)N(C=C2C(=O)N=C(N)N)CC3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)N(C=C2C(=O)N=C(N)N)CC3=CC=C(C=C3)F

InChI

InChI=1S/C19H17FN4O2/c1-11-2-7-14-15(8-11)16(17(25)23-19(21)22)10-24(18(14)26)9-12-3-5-13(20)6-4-12/h2-8,10H,9H2,1H3,(H4,21,22,23,25)