4-cycloheptyl-N-(2,6-diethylphenyl)piperazine-1-carbothioamide

Systemtic Name: 4-cycloheptyl-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Openeye Name: 4-cycloheptyl-N-(2,6-diethylphenyl)piperazine-1-carbothioamide CAS Name: 4-cycloheptyl-N-(2,6-diethylphenyl)-1-piperazinecarbothioamide IUPAC Name: 4-cycloheptyl-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Traditional Name: 4-cycloheptyl-N-(2,6-diethylphenyl)piperazine-1-carbothioamide Formula: C22H35N3S MolecularWeight: 373.5984

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3CCCCCC3

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=S)N2CCN(CC2)C3CCCCCC3

InChI

InChI=1S/C22H35N3S/c1-3-18-10-9-11-19(4-2)21(18)23-22(26)25-16-14-24(15-17-25)20-12-7-5-6-8-13-20/h9-11,20H,3-8,12-17H2,1-2H3,(H,23,26)