3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione

Systemtic Name: 3-[4-oxidanylidene-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Openeye Name: 3-[4-oxo-4-[4-(2-pyridyl)piperazin-1-yl]butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione CAS Name: 3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione IUPAC Name: 3-[4-oxo-4-(4-pyridin-2-ylpiperazin-1-yl)butyl]-1H-thieno[3,2-d]pyrimidine-2,4-dione Traditional Name: 3-[4-keto-4-[4-(2-pyridyl)piperazino]butyl]-1H-thieno[3,2-d]pyrimidine-2,4-quinone Formula: C19H21N5O3S MolecularWeight: 399.46674

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCCN3C(=O)C4=C(C=CS4)NC3=O

InChI

InChI=1S/C19H21N5O3S/c25-16(23-11-9-22(10-12-23)15-4-1-2-7-20-15)5-3-8-24-18(26)17-14(6-13-28-17)21-19(24)27/h1-2,4,6-7,13H,3,5,8-12H2,(H,21,27)