N-[bis(azanyl)methylidene]-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-2-(3,4-dimethylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-(3,4-dimethylphenyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-(3,4-dimethylphenyl)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-(3,4-dimethylphenyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(3,4-dimethylphenyl)-1-keto-isoquinoline-4-carboxamide Formula: C19H18N4O2 MolecularWeight: 334.37182

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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