3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-[ethyl-[(2-methoxy-5-nitro-phenyl)methyl]amino]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[bis(azanyl)methylidene]-6-chloranyl-5-[ethyl-[(2-methoxy-5-nitro-phenyl)methyl]amino]pyrazine-2-carboxamide Openeye Name: 3-amino-6-chloro-N-(diaminomethylene)-5-[ethyl-[(2-methoxy-5-nitro-phenyl)methyl]amino]pyrazine-2-carboxamide CAS Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-[ethyl-[(2-methoxy-5-nitrophenyl)methyl]amino]-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-chloro-N-(diaminomethylidene)-5-[ethyl-[(2-methoxy-5-nitrophenyl)methyl]amino]pyrazine-2-carboxamide Traditional Name: 3-amino-6-chloro-N-(diaminomethylene)-5-[ethyl-(2-methoxy-5-nitro-benzyl)amino]pyrazinamide Formula: C16H19ClN8O4 MolecularWeight: 422.82626

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=C(C=CC(=C1)[N+](=O)[O-])OC)C2=NC(=C(N=C2Cl)C(=O)N=C(N)N)N

Isomeric SMILES

CCN(CC1=C(C=CC(=C1)[N+](=O)[O-])OC)C2=NC(=C(N=C2Cl)C(=O)N=C(N)N)N

InChI

InChI=1S/C16H19ClN8O4/c1-3-24(7-8-6-9(25(27)28)4-5-10(8)29-2)14-12(17)21-11(13(18)22-14)15(26)23-16(19)20/h4-6H,3,7H2,1-2H3,(H2,18,22)(H4,19,20,23,26)