2-azanyl-4-oxidanylidene-5-phenethyl-1H-pyrimidine-6-carbaldehyde hydrochloride

Systemtic Name: 2-azanyl-4-oxidanylidene-5-phenethyl-1H-pyrimidine-6-carbaldehyde hydrochloride Openeye Name: 2-amino-4-oxo-5-phenethyl-1H-pyrimidine-6-carbaldehyde hydrochloride CAS Name: 2-amino-4-oxo-5-phenethyl-1H-pyrimidine-6-carboxaldehyde hydrochloride IUPAC Name: 2-amino-4-oxo-5-phenethyl-1H-pyrimidine-6-carbaldehyde hydrochloride Traditional Name: 2-amino-4-keto-5-phenethyl-1H-pyrimidine-6-carbaldehyde hydrochloride Formula: C13H14ClN3O2 MolecularWeight: 279.72216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=C(NC(=NC2=O)N)C=O.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCC2=C(NC(=NC2=O)N)C=O.Cl

InChI

InChI=1S/C13H13N3O2.ClH/c14-13-15-11(8-17)10(12(18)16-13)7-6-9-4-2-1-3-5-9;/h1-5,8H,6-7H2,(H3,14,15,16,18);1H