6-azanylidene-3-[4-(4-azanylidene-3-carbamimidoyl-5-cyano-2-oxidanylidene-pyrimidin-1-yl)phenyl]-5-cyano-2-oxidanylidene-pyrimidine-1-carboximidamide

Systemtic Name: 6-azanylidene-3-[4-(4-azanylidene-3-carbamimidoyl-5-cyano-2-oxidanylidene-pyrimidin-1-yl)phenyl]-5-cyano-2-oxidanylidene-pyrimidine-1-carboximidamide Openeye Name: 3-[4-(3-carbamimidoyl-5-cyano-4-imino-2-oxo-pyrimidin-1-yl)phenyl]-5-cyano-6-imino-2-oxo-pyrimidine-1-carboxamidine CAS Name: 3-[4-(3-carbamimidoyl-5-cyano-4-imino-2-oxo-1-pyrimidinyl)phenyl]-5-cyano-6-imino-2-oxo-1-pyrimidinecarboximidamide IUPAC Name: 3-[4-(3-carbamimidoyl-5-cyano-4-imino-2-oxopyrimidin-1-yl)phenyl]-5-cyano-6-imino-2-oxopyrimidine-1-carboximidamide Traditional Name: 3-[4-(3-amidino-5-cyano-4-imino-2-keto-pyrimidin-1-yl)phenyl]-5-cyano-6-imino-2-keto-pyrimidine-1-carboxamidine Formula: C18H14N12O2 MolecularWeight: 430.38296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C=C(C(=N)N(C2=O)C(=N)N)C#N)N3C=C(C(=N)N(C3=O)C(=N)N)C#N

Isomeric SMILES

C1=CC(=CC=C1N2C=C(C(=N)N(C2=O)C(=N)N)C#N)N3C=C(C(=N)N(C3=O)C(=N)N)C#N

InChI

InChI=1S/C18H14N12O2/c19-5-9-7-27(17(31)29(13(9)21)15(23)24)11-1-2-12(4-3-11)28-8-10(6-20)14(22)30(16(25)26)18(28)32/h1-4,7-8,21-22H,(H3,23,24)(H3,25,26)