N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide Openeye Name: N-[2-(2-furylmethylsulfanyl)ethyl]-4-pyrimidin-2-yl-piperazine-1-carboxamide CAS Name: N-[2-(2-furanylmethylthio)ethyl]-4-(2-pyrimidinyl)-1-piperazinecarboxamide IUPAC Name: N-[2-(furan-2-ylmethylsulfanyl)ethyl]-4-pyrimidin-2-ylpiperazine-1-carboxamide Traditional Name: N-[2-(2-furfurylthio)ethyl]-4-(2-pyrimidyl)piperazine-1-carboxamide Formula: C16H21N5O2S MolecularWeight: 347.43524

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)NCCSCC3=CC=CO3

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)NCCSCC3=CC=CO3

InChI

InChI=1S/C16H21N5O2S/c22-16(19-6-12-24-13-14-3-1-11-23-14)21-9-7-20(8-10-21)15-17-4-2-5-18-15/h1-5,11H,6-10,12-13H2,(H,19,22)