3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]pyrazine-2-carboxamide Openeye Name: 3-amino-6-chloro-N-(diaminomethylene)-5-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]pyrazine-2-carboxamide CAS Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-[4-[2-(3-methoxyphenoxy)ethyl]-1-piperazinyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-[4-[2-(3-methoxyphenoxy)ethyl]piperazin-1-yl]pyrazine-2-carboxamide Traditional Name: 3-amino-6-chloro-N-(diaminomethylene)-5-[4-[2-(3-methoxyphenoxy)ethyl]piperazino]pyrazinamide Formula: C19H25ClN8O3 MolecularWeight: 448.9066

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)OCCN2CCN(CC2)C3=NC(=C(N=C3Cl)C(=O)N=C(N)N)N

Isomeric SMILES

COC1=CC(=CC=C1)OCCN2CCN(CC2)C3=NC(=C(N=C3Cl)C(=O)N=C(N)N)N

InChI

InChI=1S/C19H25ClN8O3/c1-30-12-3-2-4-13(11-12)31-10-9-27-5-7-28(8-6-27)17-15(20)24-14(16(21)25-17)18(29)26-19(22)23/h2-4,11H,5-10H2,1H3,(H2,21,25)(H4,22,23,26,29)