2-azanyl-3-[4-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]butyl]benzaldehyde

Systemtic Name: 2-azanyl-3-[4-[2,6-bis(azanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]butyl]benzaldehyde Openeye Name: 2-amino-3-[4-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)butyl]benzaldehyde CAS Name: 2-amino-3-[4-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)butyl]benzaldehyde IUPAC Name: 2-amino-3-[4-(2,6-diamino-4-oxo-1H-pyrimidin-5-yl)butyl]benzaldehyde Traditional Name: 2-amino-3-[4-(2,6-diamino-4-keto-1H-pyrimidin-5-yl)butyl]benzaldehyde Formula: C15H19N5O2 MolecularWeight: 301.34366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)CCCCC2=C(NC(=NC2=O)N)N)N)C=O

Isomeric SMILES

C1=CC(=C(C(=C1)CCCCC2=C(NC(=NC2=O)N)N)N)C=O

InChI

InChI=1S/C15H19N5O2/c16-12-9(5-3-6-10(12)8-21)4-1-2-7-11-13(17)19-15(18)20-14(11)22/h3,5-6,8H,1-2,4,7,16H2,(H5,17,18,19,20,22)