4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide

Systemtic Name: 4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Openeye Name: 4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide CAS Name: 4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]-1-piperazinecarbothioamide IUPAC Name: 4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Traditional Name: 4-(2-fluorophenyl)sulfonyl-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Formula: C18H26FN3O2S2 MolecularWeight: 399.546343

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C18H26FN3O2S2/c1-14-6-2-4-8-16(14)20-18(25)21-10-12-22(13-11-21)26(23,24)17-9-5-3-7-15(17)19/h3,5,7,9,14,16H,2,4,6,8,10-13H2,1H3,(H,20,25)/t14-,16-/m0/s1