2-azanyl-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride

Systemtic Name: 2-azanyl-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride Openeye Name: 2-amino-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride CAS Name: 2-amino-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride IUPAC Name: 2-amino-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride Traditional Name: 2-amino-7,7-dimethyl-6-(3-phenylpropoxymethyl)-1,5,6,8-tetrahydropteridin-4-one dihydrochloride Formula: C18H27Cl2N5O2 MolecularWeight: 416.34528

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(NC2=C(N1)NC(=NC2=O)N)COCCCC3=CC=CC=C3)C.Cl.Cl

Isomeric SMILES

CC1(C(NC2=C(N1)NC(=NC2=O)N)COCCCC3=CC=CC=C3)C.Cl.Cl

InChI

InChI=1S/C18H25N5O2.2ClH/c1-18(2)13(11-25-10-6-9-12-7-4-3-5-8-12)20-14-15(23-18)21-17(19)22-16(14)24;;/h3-5,7-8,13,20H,6,9-11H2,1-2H3,(H4,19,21,22,23,24);2*1H