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

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2,4-dimethylphenyl)-6-methyl-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(2,4-dimethylphenyl)-6-methyl-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(2,4-dimethylphenyl)-6-methyl-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(2,4-dimethylphenyl)-6-methyl-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(2,4-dimethylphenyl)-1-keto-6-methyl-isoquinoline-4-carboxamide Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=C(C3=C(C2=O)C=CC(=C3)C)C(=O)N=C(N)N)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=C(C3=C(C2=O)C=CC(=C3)C)C(=O)N=C(N)N)C

InChI

InChI=1S/C20H20N4O2/c1-11-5-7-17(13(3)8-11)24-10-16(18(25)23-20(21)22)15-9-12(2)4-6-14(15)19(24)26/h4-10H,1-3H3,(H4,21,22,23,25)