N-[bis(azanyl)methylidene]-2-(2,5-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(2,5-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(2,5-dimethylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(2,5-dimethylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(2,5-dimethylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(2,5-dimethylphenyl)-1-keto-isoquinoline-4-carboxamide Formula: C19H18N4O2 MolecularWeight: 334.37182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4O2/c1-11-7-8-12(2)16(9-11)23-10-15(17(24)22-19(20)21)13-5-3-4-6-14(13)18(23)25/h3-10H,1-2H3,(H4,20,21,22,24)