4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(phenylmethyl)piperazine-1-carbothioamide

Systemtic Name: 4-[(1,5-dimethylpyrazol-4-yl)methyl]-N-(phenylmethyl)piperazine-1-carbothioamide Openeye Name: N-benzyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbothioamide CAS Name: 4-[(1,5-dimethyl-4-pyrazolyl)methyl]-N-(phenylmethyl)-1-piperazinecarbothioamide IUPAC Name: N-benzyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbothioamide Traditional Name: N-benzyl-4-[(1,5-dimethylpyrazol-4-yl)methyl]piperazine-1-carbothioamide Formula: C18H25N5S MolecularWeight: 343.4896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CN2CCN(CC2)C(=S)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=NN1C)CN2CCN(CC2)C(=S)NCC3=CC=CC=C3

InChI

InChI=1S/C18H25N5S/c1-15-17(13-20-21(15)2)14-22-8-10-23(11-9-22)18(24)19-12-16-6-4-3-5-7-16/h3-7,13H,8-12,14H2,1-2H3,(H,19,24)