3-azanyl-6-chloranyl-N-[N-(ethylcarbamoyl)-N'-methyl-carbamimidoyl]-5-(propan-2-ylamino)pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-6-chloranyl-N-[N-(ethylcarbamoyl)-N'-methyl-carbamimidoyl]-5-(propan-2-ylamino)pyrazine-2-carboxamide Openeye Name: 3-amino-6-chloro-N-[N-(ethylcarbamoyl)-N'-methyl-carbamimidoyl]-5-(isopropylamino)pyrazine-2-carboxamide CAS Name: 3-amino-6-chloro-N-[(ethylcarbamoylamino)-methyliminomethyl]-5-(propan-2-ylamino)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-chloro-N-[N-(ethylcarbamoyl)-N'-methylcarbamimidoyl]-5-(propan-2-ylamino)pyrazine-2-carboxamide Traditional Name: 3-amino-6-chloro-N-[N-(ethylcarbamoyl)-N'-methyl-amidino]-5-(isopropylamino)pyrazinamide Formula: C13H21ClN8O2 MolecularWeight: 356.81124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=NC)NC(=O)C1=C(N=C(C(=N1)Cl)NC(C)C)N

Isomeric SMILES

CCNC(=O)NC(=NC)NC(=O)C1=C(N=C(C(=N1)Cl)NC(C)C)N

InChI

InChI=1S/C13H21ClN8O2/c1-5-17-13(24)22-12(16-4)21-11(23)7-9(15)20-10(8(14)19-7)18-6(2)3/h6H,5H2,1-4H3,(H3,15,18,20)(H3,16,17,21,22,23,24)