(2R)-N-ethyl-2-(1-methylpyrrol-2-yl)azepane-1-carbothioamide

Systemtic Name: (2R)-N-ethyl-2-(1-methylpyrrol-2-yl)azepane-1-carbothioamide Openeye Name: (2R)-N-ethyl-2-(1-methylpyrrol-2-yl)azepane-1-carbothioamide CAS Name: (2R)-N-ethyl-2-(1-methyl-2-pyrrolyl)-1-azepanecarbothioamide IUPAC Name: (2R)-N-ethyl-2-(1-methylpyrrol-2-yl)azepane-1-carbothioamide Traditional Name: (2R)-N-ethyl-2-(1-methylpyrrol-2-yl)azepane-1-carbothioamide Formula: C14H23N3S MolecularWeight: 265.41752

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)N1CCCCCC1C2=CC=CN2C

Isomeric SMILES

CCNC(=S)N1CCCCC[C@@H]1C2=CC=CN2C

InChI

InChI=1S/C14H23N3S/c1-3-15-14(18)17-11-6-4-5-8-13(17)12-9-7-10-16(12)2/h7,9-10,13H,3-6,8,11H2,1-2H3,(H,15,18)/t13-/m1/s1