2-azanylidene-3-oxidanyl-6-piperidin-1-yl-pyrimidin-4-amine; 2-ethenylbenzenesulfonate

Systemtic Name: 2-azanylidene-3-oxidanyl-6-piperidin-1-yl-pyrimidin-4-amine; 2-ethenylbenzenesulfonate Openeye Name: 3-hydroxy-2-imino-6-(1-piperidyl)pyrimidin-4-amine; 2-vinylbenzenesulfonate CAS Name: 2-ethenylbenzenesulfonate; 3-hydroxy-2-imino-6-(1-piperidinyl)-4-pyrimidinamine IUPAC Name: 2-ethenylbenzenesulfonate; 3-hydroxy-2-imino-6-piperidin-1-ylpyrimidin-4-amine Traditional Name: (3-hydroxy-2-imino-6-piperidino-pyrimidin-4-yl)amine; 2-vinylbesylate Formula: C17H22N5O4S- MolecularWeight: 392.45268

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1S(=O)(=O)[O-].C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O

Isomeric SMILES

C=CC1=CC=CC=C1S(=O)(=O)[O-].C1CCN(CC1)C2=NC(=N)N(C(=C2)N)O

InChI

InChI=1S/C9H15N5O.C8H8O3S/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13;1-2-7-5-3-4-6-8(7)12(9,10)11/h6,11,15H,1-5,10H2;2-6H,1H2,(H,9,10,11)/p-1