6-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one

Systemtic Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-8-(2-thienylmethyl)pteridin-7-one CAS Name: 6-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 6-(4-methoxyphenyl)-2-(4-methylpiperazino)-8-(2-thenyl)pteridin-7-one Formula: C23H24N6O2S MolecularWeight: 448.54066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=C(C=C4)OC)CC5=CC=CS5

Isomeric SMILES

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)C4=CC=C(C=C4)OC)CC5=CC=CS5

InChI

InChI=1S/C23H24N6O2S/c1-27-9-11-28(12-10-27)23-24-14-19-21(26-23)29(15-18-4-3-13-32-18)22(30)20(25-19)16-5-7-17(31-2)8-6-16/h3-8,13-14H,9-12,15H2,1-2H3