3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-yl)pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-(3,4-dihydro-1H-isoquinolin-2-yl)pyrazine-2-carboxamide Openeye Name: 3-amino-6-chloro-N-(diaminomethylene)-5-(3,4-dihydro-1H-isoquinolin-2-yl)pyrazine-2-carboxamide CAS Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-(3,4-dihydro-1H-isoquinolin-2-yl)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-(3,4-dihydro-1H-isoquinolin-2-yl)pyrazine-2-carboxamide Traditional Name: 3-amino-6-chloro-N-(diaminomethylene)-5-(3,4-dihydro-1H-isoquinolin-2-yl)pyrazinamide Formula: C15H16ClN7O MolecularWeight: 345.78684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC(=C(N=C3Cl)C(=O)N=C(N)N)N

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC(=C(N=C3Cl)C(=O)N=C(N)N)N

InChI

InChI=1S/C15H16ClN7O/c16-11-13(21-12(17)10(20-11)14(24)22-15(18)19)23-6-5-8-3-1-2-4-9(8)7-23/h1-4H,5-7H2,(H2,17,21)(H4,18,19,22,24)