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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=C(N(N=C3)CC)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=S)N2CCN(CC2)CC3=C(N(N=C3)CC)C

InChI

InChI=1S/C20H29N5S/c1-4-17-6-8-19(9-7-17)22-20(26)24-12-10-23(11-13-24)15-18-14-21-25(5-2)16(18)3/h6-9,14H,4-5,10-13,15H2,1-3H3,(H,22,26)