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

Systemtic Name: N-[(2S)-2-ethylhexyl]-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Openeye Name: N-[(2S)-2-ethylhexyl]-4-(4-hydroxyphenyl)piperazine-1-carbothioamide CAS Name: N-[(2S)-2-ethylhexyl]-4-(4-hydroxyphenyl)-1-piperazinecarbothioamide IUPAC Name: N-[(2S)-2-ethylhexyl]-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Traditional Name: N-[(2S)-2-ethylhexyl]-4-(4-hydroxyphenyl)piperazine-1-carbothioamide Formula: C19H31N3OS MolecularWeight: 349.53394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CNC(=S)N1CCN(CC1)C2=CC=C(C=C2)O

Isomeric SMILES

CCCC[C@H](CC)CNC(=S)N1CCN(CC1)C2=CC=C(C=C2)O

InChI

InChI=1S/C19H31N3OS/c1-3-5-6-16(4-2)15-20-19(24)22-13-11-21(12-14-22)17-7-9-18(23)10-8-17/h7-10,16,23H,3-6,11-15H2,1-2H3,(H,20,24)/t16-/m0/s1