4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxo-butanoic acid CAS Name: 4-[4-(6-ethyl-4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]-4-oxobutanoic acid IUPAC Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazin-1-yl]-4-oxobutanoic acid Traditional Name: 4-[4-(6-ethylthieno[2,3-d]pyrimidin-4-yl)piperazino]-4-keto-butyric acid Formula: C16H20N4O3S MolecularWeight: 348.42

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCC(=O)O

Isomeric SMILES

CCC1=CC2=C(N=CN=C2S1)N3CCN(CC3)C(=O)CCC(=O)O

InChI

InChI=1S/C16H20N4O3S/c1-2-11-9-12-15(17-10-18-16(12)24-11)20-7-5-19(6-8-20)13(21)3-4-14(22)23/h9-10H,2-8H2,1H3,(H,22,23)