3-[6-oxidanylidene-6-(4-pyrimidin-2-ylpiperazin-1-yl)hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[6-oxidanylidene-6-(4-pyrimidin-2-ylpiperazin-1-yl)hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[6-oxo-6-(4-pyrimidin-2-ylpiperazin-1-yl)hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[6-oxo-6-[4-(2-pyrimidinyl)-1-piperazinyl]hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[6-oxo-6-(4-pyrimidin-2-ylpiperazin-1-yl)hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[6-keto-6-[4-(2-pyrimidyl)piperazino]hexyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C20H24N6O3S MolecularWeight: 428.50796

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCCCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)CCCCCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C20H24N6O3S/c27-16(24-10-12-25(13-11-24)19-21-7-4-8-22-19)5-2-1-3-9-26-18(28)17-15(6-14-30-17)23-20(26)29/h4,6-8,14H,1-3,5,9-13H2,(H,23,29)