N-(3-ethylphenyl)pyrrolidine-1-carbothioamide

Systemtic Name: N-(3-ethylphenyl)pyrrolidine-1-carbothioamide Openeye Name: N-(3-ethylphenyl)pyrrolidine-1-carbothioamide CAS Name: N-(3-ethylphenyl)-1-pyrrolidinecarbothioamide IUPAC Name: N-(3-ethylphenyl)pyrrolidine-1-carbothioamide Traditional Name: N-(3-ethylphenyl)pyrrolidine-1-carbothioamide Formula: C13H18N2S MolecularWeight: 234.36042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=S)N2CCCC2

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=S)N2CCCC2

InChI

InChI=1S/C13H18N2S/c1-2-11-6-5-7-12(10-11)14-13(16)15-8-3-4-9-15/h5-7,10H,2-4,8-9H2,1H3,(H,14,16)