2-[(4-methoxyphenyl)amino]-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-pteridin-7-one

Systemtic Name: 2-[(4-methoxyphenyl)amino]-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-pteridin-7-one Openeye Name: 2-(4-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-(2-thienyl)pteridin-7-one CAS Name: 2-(4-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-yl-7-pteridinone IUPAC Name: 2-(4-methoxyanilino)-8-[(3-methoxyphenyl)methyl]-6-thiophen-2-ylpteridin-7-one Traditional Name: 8-m-anisyl-2-(p-anisidino)-6-(2-thienyl)pteridin-7-one Formula: C25H21N5O3S MolecularWeight: 471.53094

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)CC5=CC(=CC=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=CS4)CC5=CC(=CC=C5)OC

InChI

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