4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]-1-methyl-cyclohex-3-ene-1-carbaldehyde

Systemtic Name: 4-[(2-azanyl-4-oxidanylidene-1H-pteridin-6-yl)methylamino]-1-methyl-cyclohex-3-ene-1-carbaldehyde Openeye Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-1-methyl-cyclohex-3-ene-1-carbaldehyde CAS Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-1-methyl-1-cyclohex-3-enecarboxaldehyde IUPAC Name: 4-[(2-amino-4-oxo-1H-pteridin-6-yl)methylamino]-1-methylcyclohex-3-ene-1-carbaldehyde Traditional Name: 4-[(2-amino-4-keto-1H-pteridin-6-yl)methylamino]-1-methyl-cyclohex-3-ene-1-carbaldehyde Formula: C15H18N6O2 MolecularWeight: 314.34242

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC(=CC1)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O

Isomeric SMILES

CC1(CCC(=CC1)NCC2=CN=C3C(=N2)C(=O)N=C(N3)N)C=O

InChI

InChI=1S/C15H18N6O2/c1-15(8-22)4-2-9(3-5-15)17-6-10-7-18-12-11(19-10)13(23)21-14(16)20-12/h2,7-8,17H,3-6H2,1H3,(H3,16,18,20,21,23)