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

Systemtic Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-naphthalen-1-yl-piperazine-1-carbothioamide Openeye Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(1-naphthyl)piperazine-1-carbothioamide CAS Name: 4-[(1-ethyl-5-methyl-4-pyrazolyl)methyl]-N-(1-naphthalenyl)-1-piperazinecarbothioamide IUPAC Name: 4-[(1-ethyl-5-methylpyrazol-4-yl)methyl]-N-naphthalen-1-ylpiperazine-1-carbothioamide Traditional Name: 4-[(1-ethyl-5-methyl-pyrazol-4-yl)methyl]-N-(1-naphthyl)piperazine-1-carbothioamide Formula: C22H27N5S MolecularWeight: 393.54828

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCN1C(=C(C=N1)CN2CCN(CC2)C(=S)NC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C22H27N5S/c1-3-27-17(2)19(15-23-27)16-25-11-13-26(14-12-25)22(28)24-21-10-6-8-18-7-4-5-9-20(18)21/h4-10,15H,3,11-14,16H2,1-2H3,(H,24,28)