3,5-bis(azanyl)-6-chloranyl-N-[N'-(12-oxidanylidene-12-piperidin-1-yl-dodecyl)carbamimidoyl]pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-6-chloranyl-N-[N'-(12-oxidanylidene-12-piperidin-1-yl-dodecyl)carbamimidoyl]pyrazine-2-carboxamide Openeye Name: 3,5-diamino-6-chloro-N-[N'-[12-oxo-12-(1-piperidyl)dodecyl]carbamimidoyl]pyrazine-2-carboxamide CAS Name: 3,5-diamino-N-[amino-[12-oxo-12-(1-piperidinyl)dodecyl]iminomethyl]-6-chloro-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-6-chloro-N-[N'-(12-oxo-12-piperidin-1-yldodecyl)carbamimidoyl]pyrazine-2-carboxamide Traditional Name: 3,5-diamino-6-chloro-N-[N'-(12-keto-12-piperidino-dodecyl)amidino]pyrazinamide Formula: C23H39ClN8O2 MolecularWeight: 495.06116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CCCCCCCCCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N

Isomeric SMILES

C1CCN(CC1)C(=O)CCCCCCCCCCCN=C(N)NC(=O)C2=C(N=C(C(=N2)Cl)N)N

InChI

InChI=1S/C23H39ClN8O2/c24-19-21(26)30-20(25)18(29-19)22(34)31-23(27)28-14-10-7-5-3-1-2-4-6-9-13-17(33)32-15-11-8-12-16-32/h1-16H2,(H4,25,26,30)(H3,27,28,31,34)