N-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-1-carbothioamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-1-carbothioamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-1-carbothioamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-pyrrolidinecarbothioamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-1-carbothioamide Traditional Name: N-homoveratrylpyrrolidine-1-carbothioamide Formula: C15H22N2O2S MolecularWeight: 294.41238

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=S)N2CCCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=S)N2CCCC2)OC

InChI

InChI=1S/C15H22N2O2S/c1-18-13-6-5-12(11-14(13)19-2)7-8-16-15(20)17-9-3-4-10-17/h5-6,11H,3-4,7-10H2,1-2H3,(H,16,20)