N-[bis(azanyl)methylidene]-1-oxidanylidene-2-(4-propan-2-ylphenyl)isoquinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-1-oxidanylidene-2-(4-propan-2-ylphenyl)isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(4-isopropylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-1-oxo-2-(4-propan-2-ylphenyl)-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-1-oxo-2-(4-propan-2-ylphenyl)isoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-1-keto-2-p-cumenyl-isoquinoline-4-carboxamide Formula: C20H20N4O2 MolecularWeight: 348.3984

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N4O2/c1-12(2)13-7-9-14(10-8-13)24-11-17(18(25)23-20(21)22)15-5-3-4-6-16(15)19(24)26/h3-12H,1-2H3,(H4,21,22,23,25)