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

Systemtic Name: 2-(4-methylpiperazin-1-yl)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Openeye Name: 2-(4-methylpiperazin-1-yl)-6-phenethyl-8-(2-thienylmethyl)pteridin-7-one CAS Name: 2-(4-methyl-1-piperazinyl)-6-phenethyl-8-(thiophen-2-ylmethyl)-7-pteridinone IUPAC Name: 2-(4-methylpiperazin-1-yl)-6-phenethyl-8-(thiophen-2-ylmethyl)pteridin-7-one Traditional Name: 2-(4-methylpiperazino)-6-phenethyl-8-(2-thenyl)pteridin-7-one Formula: C24H26N6OS MolecularWeight: 446.56784

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=CS5

Isomeric SMILES

CN1CCN(CC1)C2=NC=C3C(=N2)N(C(=O)C(=N3)CCC4=CC=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C24H26N6OS/c1-28-11-13-29(14-12-28)24-25-16-21-22(27-24)30(17-19-8-5-15-32-19)23(31)20(26-21)10-9-18-6-3-2-4-7-18/h2-8,15-16H,9-14,17H2,1H3