2-azanyl-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one

Systemtic Name: 2-azanyl-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one Openeye Name: 2-amino-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one CAS Name: 2-amino-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one IUPAC Name: 2-amino-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one Traditional Name: 2-amino-6,8-bis(4-butylphenyl)-6,8-dihydro-1H-thieno[3,4-g]pteridin-4-one Formula: C28H31N5OS MolecularWeight: 485.64364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2C3=NC4=C(NC(=NC4=O)N)N=C3C(S2)C5=CC=C(C=C5)CCCC

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2C3=NC4=C(NC(=NC4=O)N)N=C3C(S2)C5=CC=C(C=C5)CCCC

InChI

InChI=1S/C28H31N5OS/c1-3-5-7-17-9-13-19(14-10-17)24-21-22(31-26-23(30-21)27(34)33-28(29)32-26)25(35-24)20-15-11-18(12-16-20)8-6-4-2/h9-16,24-25H,3-8H2,1-2H3,(H3,29,31,32,33,34)