(2S)-2-ethyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide

Systemtic Name: (2S)-2-ethyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Openeye Name: (2S)-2-ethyl-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide CAS Name: (2S)-2-ethyl-N-[4-(4-morpholinylsulfonyl)phenyl]-1-piperidinecarbothioamide IUPAC Name: (2S)-2-ethyl-N-(4-morpholin-4-ylsulfonylphenyl)piperidine-1-carbothioamide Traditional Name: (2S)-2-ethyl-N-(4-morpholinosulfonylphenyl)piperidine-1-carbothioamide Formula: C18H27N3O3S2 MolecularWeight: 397.55528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC[C@H]1CCCCN1C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H27N3O3S2/c1-2-16-5-3-4-10-21(16)18(25)19-15-6-8-17(9-7-15)26(22,23)20-11-13-24-14-12-20/h6-9,16H,2-5,10-14H2,1H3,(H,19,25)/t16-/m0/s1