4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylic acid

Systemtic Name: 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylic acid Openeye Name: 4-(4-tert-butoxycarbonylpiperazin-1-yl)thieno[2,3-d]pyrimidine-6-carboxylic acid CAS Name: 4-[4-[(2-methylpropan-2-yl)oxy-oxomethyl]-1-piperazinyl]-6-thieno[2,3-d]pyrimidinecarboxylic acid IUPAC Name: 4-[4-[(2-methylpropan-2-yl)oxycarbonyl]piperazin-1-yl]thieno[2,3-d]pyrimidine-6-carboxylic acid Traditional Name: 4-(4-tert-butoxycarbonylpiperazino)thieno[2,3-d]pyrimidine-6-carboxylic acid Formula: C16H20N4O4S MolecularWeight: 364.4194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=C(SC3=NC=N2)C(=O)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C=C(SC3=NC=N2)C(=O)O

InChI

InChI=1S/C16H20N4O4S/c1-16(2,3)24-15(23)20-6-4-19(5-7-20)12-10-8-11(14(21)22)25-13(10)18-9-17-12/h8-9H,4-7H2,1-3H3,(H,21,22)