2-oxidanylethanesulfonic acid; 6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine

Systemtic Name: 2-oxidanylethanesulfonic acid; 6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine Openeye Name: 2-hydroxyethanesulfonic acid; 6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine CAS Name: 2-hydroxyethanesulfonic acid; 6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine IUPAC Name: 2-hydroxyethanesulfonic acid; 6-pentylpyrido[2,3-d]pyrimidine-2,4-diamine Traditional Name: (2-amino-6-amyl-pyrido[2,3-d]pyrimidin-4-yl)amine; 2-hydroxyethanesulfonic acid Formula: C14H23N5O4S MolecularWeight: 357.42852

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C2C(=C1)C(=NC(=N2)N)N.C(CS(=O)(=O)O)O

Isomeric SMILES

CCCCCC1=CN=C2C(=C1)C(=NC(=N2)N)N.C(CS(=O)(=O)O)O

InChI

InChI=1S/C12H17N5.C2H6O4S/c1-2-3-4-5-8-6-9-10(13)16-12(14)17-11(9)15-7-8;3-1-2-7(4,5)6/h6-7H,2-5H2,1H3,(H4,13,14,15,16,17);3H,1-2H2,(H,4,5,6)