2-(ethylamino)-6-(4-methoxyphenyl)-8-(thiophen-2-ylmethyl)pteridin-7-one

Systemtic Name: 2-(ethylamino)-6-(4-methoxyphenyl)-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 2-(ethylamino)-6-(4-methoxyphenyl)-8-(2-thienylmethyl)pteridin-7-one CAS Name: 2-(ethylamino)-6-(4-methoxyphenyl)-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 2-(ethylamino)-6-(4-methoxyphenyl)-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 2-(ethylamino)-6-(4-methoxyphenyl)-8-(2-thenyl)pteridin-7-one Formula: C20H19N5O2S MolecularWeight: 393.46216

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=C(C=C3)OC)CC4=CC=CS4

Isomeric SMILES

CCNC1=NC=C2C(=N1)N(C(=O)C(=N2)C3=CC=C(C=C3)OC)CC4=CC=CS4

InChI

InChI=1S/C20H19N5O2S/c1-3-21-20-22-11-16-18(24-20)25(12-15-5-4-10-28-15)19(26)17(23-16)13-6-8-14(27-2)9-7-13/h4-11H,3,12H2,1-2H3,(H,21,22,24)