2-(2-bromophenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate

Systemtic Name: 2-(2-bromophenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Openeye Name: 2-(2-bromophenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate CAS Name: 4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinecarboxylic acid 2-(2-bromophenyl)ethyl ester IUPAC Name: 2-(2-bromophenyl)ethyl 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylate Traditional Name: 4-thieno[2,3-d]pyrimidin-4-ylpiperazine-1-carboxylic acid 2-(2-bromophenyl)ethyl ester Formula: C19H19BrN4O2S MolecularWeight: 447.34876

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C3C=CSC3=NC=N2)C(=O)OCCC4=CC=CC=C4Br

Isomeric SMILES

C1CN(CCN1C2=C3C=CSC3=NC=N2)C(=O)OCCC4=CC=CC=C4Br

InChI

InChI=1S/C19H19BrN4O2S/c20-16-4-2-1-3-14(16)5-11-26-19(25)24-9-7-23(8-10-24)17-15-6-12-27-18(15)22-13-21-17/h1-4,6,12-13H,5,7-11H2