[(E)-4-phenylmethoxybut-2-enyl] 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate

Systemtic Name: [(E)-4-phenylmethoxybut-2-enyl] 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Openeye Name: [(E)-4-benzyloxybut-2-enyl] 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate CAS Name: 4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinecarboxylic acid [(E)-4-phenylmethoxybut-2-enyl] ester IUPAC Name: [(E)-4-phenylmethoxybut-2-enyl] 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Traditional Name: 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylic acid [(E)-4-benzoxybut-2-enyl] ester Formula: C22H24N4O3S MolecularWeight: 424.51596

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CSC3=NC=N2)C(=O)OCC=CCOCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C3C=CSC3=NC=N2)C(=O)OC/C=C/COCC4=CC=CC=C4

InChI

InChI=1S/C22H24N4O3S/c27-22(29-14-5-4-13-28-16-18-6-2-1-3-7-18)26-11-9-25(10-12-26)20-19-8-15-30-21(19)24-17-23-20/h1-8,15,17H,9-14,16H2/b5-4+