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

Systemtic Name: N-[bis(azanyl)methylidene]-2-(4-cyclohexylphenyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(4-cyclohexylphenyl)-N-(diaminomethylene)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(4-cyclohexylphenyl)-N-(diaminomethylidene)-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(4-cyclohexylphenyl)-N-(diaminomethylidene)-1-oxoisoquinoline-4-carboxamide Traditional Name: 2-(4-cyclohexylphenyl)-N-(diaminomethylene)-1-keto-isoquinoline-4-carboxamide Formula: C23H24N4O2 MolecularWeight: 388.46226

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N3C=C(C4=CC=CC=C4C3=O)C(=O)N=C(N)N

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N3C=C(C4=CC=CC=C4C3=O)C(=O)N=C(N)N

InChI

InChI=1S/C23H24N4O2/c24-23(25)26-21(28)20-14-27(22(29)19-9-5-4-8-18(19)20)17-12-10-16(11-13-17)15-6-2-1-3-7-15/h4-5,8-15H,1-3,6-7H2,(H4,24,25,26,28)