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

Systemtic Name: N-[bis(azanyl)methylidene]-2-[(3,4-dichlorophenyl)methyl]-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: N-(diaminomethylene)-2-[(3,4-dichlorophenyl)methyl]-1-oxo-isoquinoline-4-carboxamide CAS Name: N-(diaminomethylidene)-2-[(3,4-dichlorophenyl)methyl]-1-oxo-4-isoquinolinecarboxamide IUPAC Name: N-(diaminomethylidene)-2-[(3,4-dichlorophenyl)methyl]-1-oxoisoquinoline-4-carboxamide Traditional Name: N-(diaminomethylene)-2-(3,4-dichlorobenzyl)-1-keto-isoquinoline-4-carboxamide Formula: C18H14Cl2N4O2 MolecularWeight: 389.23536

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)C(=O)N=C(N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN(C2=O)CC3=CC(=C(C=C3)Cl)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C18H14Cl2N4O2/c19-14-6-5-10(7-15(14)20)8-24-9-13(16(25)23-18(21)22)11-3-1-2-4-12(11)17(24)26/h1-7,9H,8H2,(H4,21,22,23,25)