(2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-prop-2-enyl-pyrrolidine-1-carbothioamide

Systemtic Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-prop-2-enyl-pyrrolidine-1-carbothioamide Openeye Name: (2R)-N-allyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbothioamide CAS Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-prop-2-enyl-1-pyrrolidinecarbothioamide IUPAC Name: (2R)-2-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-prop-2-enylpyrrolidine-1-carbothioamide Traditional Name: (2R)-N-allyl-2-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrrolidine-1-carbothioamide Formula: C16H20N2O2S MolecularWeight: 304.4072

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)N1CCCC1C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

C=CCNC(=S)N1CCC[C@@H]1C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C16H20N2O2S/c1-2-7-17-16(21)18-8-3-4-13(18)12-5-6-14-15(11-12)20-10-9-19-14/h2,5-6,11,13H,1,3-4,7-10H2,(H,17,21)/t13-/m1/s1