ethyl 4-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanylcarbothioyl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanylcarbothioyl)piperazine-1-carboxylate Openeye Name: ethyl 4-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanylcarbothioyl)piperazine-1-carboxylate CAS Name: 4-[(2-imidazo[1,2-a]pyrimidinylmethylthio)-sulfanylidenemethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanylcarbothioyl)piperazine-1-carboxylate Traditional Name: 4-(imidazo[1,2-a]pyrimidin-2-ylmethylthio)carbothioylpiperazine-1-carboxylic acid ethyl ester Formula: C15H19N5O2S2 MolecularWeight: 365.47366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=S)SCC2=CN3C=CC=NC3=N2

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=S)SCC2=CN3C=CC=NC3=N2

InChI

InChI=1S/C15H19N5O2S2/c1-2-22-14(21)18-6-8-19(9-7-18)15(23)24-11-12-10-20-5-3-4-16-13(20)17-12/h3-5,10H,2,6-9,11H2,1H3