4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-phenyl-piperazine-1-carbothioamide

Systemtic Name: 4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-phenyl-piperazine-1-carbothioamide Openeye Name: 4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-phenyl-piperazine-1-carbothioamide CAS Name: 4-[(1-ethyl-3-methyl-4-pyrazolyl)methyl]-N-phenyl-1-piperazinecarbothioamide IUPAC Name: 4-[(1-ethyl-3-methylpyrazol-4-yl)methyl]-N-phenylpiperazine-1-carbothioamide Traditional Name: 4-[(1-ethyl-3-methyl-pyrazol-4-yl)methyl]-N-phenyl-piperazine-1-carbothioamide Formula: C18H25N5S MolecularWeight: 343.4896

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=S)NC3=CC=CC=C3

Isomeric SMILES

CCN1C=C(C(=N1)C)CN2CCN(CC2)C(=S)NC3=CC=CC=C3

InChI

InChI=1S/C18H25N5S/c1-3-23-14-16(15(2)20-23)13-21-9-11-22(12-10-21)18(24)19-17-7-5-4-6-8-17/h4-8,14H,3,9-13H2,1-2H3,(H,19,24)