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

Systemtic Name: 4-(4-hydroxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Openeye Name: 4-(4-hydroxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide CAS Name: 4-(4-hydroxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-hydroxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Traditional Name: 4-(4-hydroxyphenyl)-N-[(1S,2S)-2-methylcyclohexyl]piperazine-1-carbothioamide Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3OS/c1-14-4-2-3-5-17(14)19-18(23)21-12-10-20(11-13-21)15-6-8-16(22)9-7-15/h6-9,14,17,22H,2-5,10-13H2,1H3,(H,19,23)/t14-,17-/m0/s1