4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide Openeye Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(tetrahydrofuran-2-ylmethyl)piperazine-1-carbothioamide CAS Name: 4-[(1,5-dimethyl-4-pyrazolyl)methyl]-N-(2-oxolanylmethyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(oxolan-2-ylmethyl)piperazine-1-carbothioamide Traditional Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(tetrahydrofurfuryl)piperazine-1-carbothioamide Formula: C16H27N5OS MolecularWeight: 337.48348

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2CCN(CC2)C(=S)NCC3CCCO3

Isomeric SMILES

CC1=C(C=NN1C)CN2CCN(CC2)C(=S)NCC3CCCO3

InChI

InChI=1S/C16H27N5OS/c1-13-14(10-18-19(13)2)12-20-5-7-21(8-6-20)16(23)17-11-15-4-3-9-22-15/h10,15H,3-9,11-12H2,1-2H3,(H,17,23)