4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-phenethyl-piperazine-1-carbothioamide

Systemtic Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-phenethyl-piperazine-1-carbothioamide Openeye Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-phenethyl-piperazine-1-carbothioamide CAS Name: 4-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-N-phenethyl-1-piperazinecarbothioamide IUPAC Name: 4-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-phenethylpiperazine-1-carbothioamide Traditional Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-phenethyl-piperazine-1-carbothioamide Formula: C20H29N5S MolecularWeight: 371.54276

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NCCC3=CC=CC=C3)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NCCC3=CC=CC=C3)C

InChI

InChI=1S/C20H29N5S/c1-3-25-17(2)19(15-22-25)16-23-11-13-24(14-12-23)20(26)21-10-9-18-7-5-4-6-8-18/h4-8,15H,3,9-14,16H2,1-2H3,(H,21,26)