2-[(3-methoxyphenyl)amino]-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-pteridin-7-one

Systemtic Name: 2-[(3-methoxyphenyl)amino]-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-pteridin-7-one Openeye Name: 2-(3-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-(2-thienyl)pteridin-7-one CAS Name: 2-(3-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-7-pteridinone IUPAC Name: 2-(3-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-ylpteridin-7-one Traditional Name: 2-(m-anisidino)-8-m-anisyl-6-(2-thienyl)pteridin-7-one Formula: C25H21N5O3S MolecularWeight: 471.53094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C3=NC(=NC=C3N=C(C2=O)C4=CC=CS4)NC5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC=CC(=C1)CN2C3=NC(=NC=C3N=C(C2=O)C4=CC=CS4)NC5=CC(=CC=C5)OC

InChI

InChI=1S/C25H21N5O3S/c1-32-18-8-3-6-16(12-18)15-30-23-20(28-22(24(30)31)21-10-5-11-34-21)14-26-25(29-23)27-17-7-4-9-19(13-17)33-2/h3-14H,15H2,1-2H3,(H,26,27,29)