2-(dimethylamino)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one

Systemtic Name: 2-(dimethylamino)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 2-(dimethylamino)-6-phenethyl-8-(2-thienylmethyl)pteridin-7-one CAS Name: 2-(dimethylamino)-6-phenethyl-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 2-(dimethylamino)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 2-(dimethylamino)-6-phenethyl-8-(2-thenyl)pteridin-7-one Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)CCC3=CC=CC=C3)CC4=CC=CS4

Isomeric SMILES

CN(C)C1=NC=C2C(=N1)N(C(=O)C(=N2)CCC3=CC=CC=C3)CC4=CC=CS4

InChI

InChI=1S/C21H21N5OS/c1-25(2)21-22-13-18-19(24-21)26(14-16-9-6-12-28-16)20(27)17(23-18)11-10-15-7-4-3-5-8-15/h3-9,12-13H,10-11,14H2,1-2H3