N-[(1S,2S)-2-methylcyclohexyl]-4-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: N-[(1S,2S)-2-methylcyclohexyl]-4-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: N-[(1S,2S)-2-methylcyclohexyl]-4-(2-pyridyl)piperazine-1-carbothioamide CAS Name: N-[(1S,2S)-2-methylcyclohexyl]-4-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: N-[(1S,2S)-2-methylcyclohexyl]-4-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: N-[(1S,2S)-2-methylcyclohexyl]-4-(2-pyridyl)piperazine-1-carbothioamide Formula: C17H26N4S MolecularWeight: 318.48014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)N2CCN(CC2)C3=CC=CC=N3

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)N2CCN(CC2)C3=CC=CC=N3

InChI

InChI=1S/C17H26N4S/c1-14-6-2-3-7-15(14)19-17(22)21-12-10-20(11-13-21)16-8-4-5-9-18-16/h4-5,8-9,14-15H,2-3,6-7,10-13H2,1H3,(H,19,22)/t14-,15-/m0/s1