3,5-bis(azanyl)-6-chloranyl-N-[N'-(8-phenyloctyl)carbamimidoyl]pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-6-chloranyl-N-[N'-(8-phenyloctyl)carbamimidoyl]pyrazine-2-carboxamide Openeye Name: 3,5-diamino-6-chloro-N-[N'-(8-phenyloctyl)carbamimidoyl]pyrazine-2-carboxamide CAS Name: 3,5-diamino-N-[amino(8-phenyloctylimino)methyl]-6-chloro-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-6-chloro-N-[N'-(8-phenyloctyl)carbamimidoyl]pyrazine-2-carboxamide Traditional Name: 3,5-diamino-6-chloro-N-[N'-(8-phenyloctyl)amidino]pyrazinamide Formula: C20H28ClN7O MolecularWeight: 417.93562

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCCCCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N

Isomeric SMILES

C1=CC=C(C=C1)CCCCCCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N

InChI

InChI=1S/C20H28ClN7O/c21-16-18(23)27-17(22)15(26-16)19(29)28-20(24)25-13-9-4-2-1-3-6-10-14-11-7-5-8-12-14/h5,7-8,11-12H,1-4,6,9-10,13H2,(H4,22,23,27)(H3,24,25,28,29)