N-(1,3-benzodioxol-5-yl)pyrrolidine-1-carbothioamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)pyrrolidine-1-carbothioamide Openeye Name: N-(1,3-benzodioxol-5-yl)pyrrolidine-1-carbothioamide CAS Name: N-(1,3-benzodioxol-5-yl)-1-pyrrolidinecarbothioamide IUPAC Name: N-(1,3-benzodioxol-5-yl)pyrrolidine-1-carbothioamide Traditional Name: N-(1,3-benzodioxol-5-yl)pyrrolidine-1-carbothioamide Formula: C12H14N2O2S MolecularWeight: 250.31676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

C1CCN(C1)C(=S)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C12H14N2O2S/c17-12(14-5-1-2-6-14)13-9-3-4-10-11(7-9)16-8-15-10/h3-4,7H,1-2,5-6,8H2,(H,13,17)