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

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

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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)C

Isomeric SMILES

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

InChI

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