3,5-bis(azanyl)-N-[2-azanyl-5-(4-methoxyphenyl)pentyl]-6-chloranyl-pyrazine-2-carboxamide

Systemtic Name: 3,5-bis(azanyl)-N-[2-azanyl-5-(4-methoxyphenyl)pentyl]-6-chloranyl-pyrazine-2-carboxamide Openeye Name: 3,5-diamino-N-[2-amino-5-(4-methoxyphenyl)pentyl]-6-chloro-pyrazine-2-carboxamide CAS Name: 3,5-diamino-N-[2-amino-5-(4-methoxyphenyl)pentyl]-6-chloro-2-pyrazinecarboxamide IUPAC Name: 3,5-diamino-N-[2-amino-5-(4-methoxyphenyl)pentyl]-6-chloropyrazine-2-carboxamide Traditional Name: 3,5-diamino-N-[2-amino-5-(4-methoxyphenyl)pentyl]-6-chloro-pyrazinamide Formula: C17H23ClN6O2 MolecularWeight: 378.85652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCCC(CNC(=O)C2=C(N=C(C(=N2)Cl)N)N)N

Isomeric SMILES

COC1=CC=C(C=C1)CCCC(CNC(=O)C2=C(N=C(C(=N2)Cl)N)N)N

InChI

InChI=1S/C17H23ClN6O2/c1-26-12-7-5-10(6-8-12)3-2-4-11(19)9-22-17(25)13-15(20)24-16(21)14(18)23-13/h5-8,11H,2-4,9,19H2,1H3,(H,22,25)(H4,20,21,24)