4-oxidanylidene-4-[4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]butanoic acid

Systemtic Name: 4-oxidanylidene-4-[4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]butanoic acid Openeye Name: 4-oxo-4-[4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]butanoic acid CAS Name: 4-oxo-4-[4-(5-phenyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]butanoic acid IUPAC Name: 4-oxo-4-[4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]butanoic acid Traditional Name: 4-keto-4-[4-(5-phenylthieno[2,3-d]pyrimidin-4-yl)piperazino]butyric acid Formula: C20H20N4O3S MolecularWeight: 396.4628

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)C(=O)CCC(=O)O

Isomeric SMILES

C1CN(CCN1C2=C3C(=CSC3=NC=N2)C4=CC=CC=C4)C(=O)CCC(=O)O

InChI

InChI=1S/C20H20N4O3S/c25-16(6-7-17(26)27)23-8-10-24(11-9-23)19-18-15(14-4-2-1-3-5-14)12-28-20(18)22-13-21-19/h1-5,12-13H,6-11H2,(H,26,27)