(2S)-N-(3-bromophenyl)-2-ethyl-piperidine-1-carbothioamide

Systemtic Name: (2S)-N-(3-bromophenyl)-2-ethyl-piperidine-1-carbothioamide Openeye Name: (2S)-N-(3-bromophenyl)-2-ethyl-piperidine-1-carbothioamide CAS Name: (2S)-N-(3-bromophenyl)-2-ethyl-1-piperidinecarbothioamide IUPAC Name: (2S)-N-(3-bromophenyl)-2-ethylpiperidine-1-carbothioamide Traditional Name: (2S)-N-(3-bromophenyl)-2-ethyl-piperidine-1-carbothioamide Formula: C14H19BrN2S MolecularWeight: 327.28306

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1C(=S)NC2=CC(=CC=C2)Br

Isomeric SMILES

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

InChI

InChI=1S/C14H19BrN2S/c1-2-13-8-3-4-9-17(13)14(18)16-12-7-5-6-11(15)10-12/h5-7,10,13H,2-4,8-9H2,1H3,(H,16,18)/t13-/m0/s1